data_2lyy_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 2lyy _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 N--CA 1.451 -0.4 0 N-CA-C 108.436 -0.95 . . . . 65.239999999999995 108.436 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -82.3 -81.17 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.519 -0.472 . . . . 73.209999999999994 110.65 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -120.4 -11.47 9.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.134 0.492 . . . . 74.239999999999995 110.977 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -108.68 169.52 8.61 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.94 -0.573 . . . . 74.549999999999997 111.547 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.81 41.98 0.76 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.614 -0.721 . . . . 75.310000000000002 111.737 -176.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -50.35 -49.91 52.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.388 -0.369 . . . . 74.439999999999998 111.645 -176.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.11 88.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.921 -0.581 . . . . 74.319999999999993 111.819 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtm105 -72.46 -51.04 21.92 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.961 -0.296 . . . . 74.420000000000002 111.618 -176.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HA ' HD22 ' A' ' 14' ' ' LEU . . . -60.5 -24.72 65.53 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.631 0.729 . . . . 71.400000000000006 110.796 -178.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -28.5 68.18 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.062 -0.972 . . . . 75.299999999999997 111.468 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.406 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.8 mt-10 -74.87 -29.21 60.95 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.37 0.605 . . . . 74.319999999999993 109.47 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.616 HD11 ' CD1' ' B' ' 236' ' ' PHE . 3.4 mm? -61.24 -45.94 92.47 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.872 -1.058 . . . . 73.030000000000001 109.694 177.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.402 HG13 ' HB2' ' B' ' 239' ' ' ALA . 65.1 mt -71.96 -27.06 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.713 -0.676 . . . . 72.430000000000007 110.276 177.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.409 ' HD2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -63.36 -31.94 73.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.063 -0.517 . . . . 75.140000000000001 110.431 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.555 HD11 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -68.34 -40.12 81.68 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.15 -0.685 . . . . 73.140000000000001 109.15 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.77 75.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 72.5 111.054 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.54 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 11.5 m-80 -58.52 -40.78 83.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 74.25 110.785 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.409 HE22 ' HD2' ' A' ' 16' ' ' LYS . 2.9 mp0 -67.12 -34.83 78.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.85 -0.614 . . . . 73.409999999999997 111.655 -178.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -76.93 -28.01 55.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.902 0.382 . . . . 75.219999999999999 110.675 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.452 ' HB2' HG22 ' A' ' 32' ' ' VAL . 2.6 t-20 -83.81 -6.32 59.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 61.409999999999997 110.794 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 46.2 mt-30 -69.97 -11.2 60.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.388 -0.369 . . . . 75.099999999999994 111.861 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.722 ' HB3' ' CG1' ' A' ' 27' ' ' ILE . 40.6 t30 -80.3 135.53 36.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.819 -0.437 . . . . 73.420000000000002 109.819 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.418 ' H ' HG21 ' A' ' 25' ' ' THR . 2.9 t -70.14 -40.58 74.71 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 113.197 0.814 . . . . 73.319999999999993 113.197 -170.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -87.43 1.33 53.72 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.433 0.531 . . . . 72.420000000000002 112.433 -174.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.722 ' CG1' ' HB3' ' A' ' 24' ' ' ASN . 13.2 mm -86.88 147.78 5.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.178 0.514 . . . . 74.239999999999995 109.658 178.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.746 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 2.2 mp0 -82.65 140.8 32.94 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.838 -0.801 . . . . 74.420000000000002 108.838 174.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.2 m -59.35 -28.18 66.6 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.147 -0.686 . . . . 73.209999999999994 109.147 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.516 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -74.09 -12.48 81.47 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.903 -1.044 . . . . 73.540000000000006 113.399 177.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.746 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 43.5 mt-10 -78.63 -35.56 45.33 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 118.079 0.94 . . . . 74.420000000000002 109.92 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 22' ' ' ASN . 21.7 t -74.22 -40.86 51.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.732 -0.667 . . . . 72.420000000000002 110.605 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 p -61.52 -44.14 97.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.063 0.458 . . . . 64.319999999999993 110.255 176.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.43 -31.03 71.91 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.659 -0.701 . . . . 74.299999999999997 110.982 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 63.4 m -67.89 -42.46 81.17 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.029 -0.36 . . . . 74.530000000000001 110.029 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.588 ' CD1' HD11 ' B' ' 214' ' ' LEU . 4.0 t80 -64.61 -33.72 76.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.698 0.761 . . . . 74.409999999999997 109.093 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.785 ' HE3' ' HB3' ' B' ' 273' ' ' TYR . 8.1 tpt -62.23 -60.08 4.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.646 -1.161 . . . . 75.310000000000002 110.935 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.443 ' CZ2' ' HD3' ' A' ' 42' ' ' ARG . 25.7 t-105 -59.36 -33.89 71.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.354 -0.839 . . . . 73.099999999999994 111.303 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.494 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -64.34 -42.99 95.97 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.232 -0.44 . . . . 55.340000000000003 110.991 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.58 HD23 ' SD ' ' B' ' 237' ' ' MET . 55.3 tp -68.83 -34.09 74.91 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 110.024 -0.361 . . . . 74.540000000000006 110.024 178.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -33.11 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 62.420000000000002 111.107 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.474 ' HG2' ' ND2' ' B' ' 280' ' ' ASN . 28.5 mtm180 -87.27 -45.59 10.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.387 -0.369 . . . . 64.420000000000002 111.061 178.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.541 ' HD2' HG22 ' B' ' 215' ' ' ILE . 18.5 t80 -68.18 -33.2 74.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.132 -0.485 . . . . 73.400000000000006 111.458 -173.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -86.49 -22.96 26.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.726 0.298 . . . . 74.230000000000004 111.6 -173.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.25 -10.4 59.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.45 0.643 . . . . 72.510000000000005 110.656 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -59.74 -24.9 64.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.014 -0.994 . . . . 73.430000000000007 111.57 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -86.65 -0.53 56.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.039 0.385 . . . . 65.340000000000003 112.039 -176.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.408 ' C ' ' HE2' ' A' ' 58' ' ' MET . . . -65.12 -29.68 75.95 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 119.982 -1.104 . . . . 62.399999999999999 110.751 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.6 m -71.57 -5.45 33.41 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.254 -0.473 . . . . 74.340000000000003 111.825 -176.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -119.24 14.84 13.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.982 0.42 . . . . 73.340000000000003 111.15 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.95 -47.76 11.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 75.420000000000002 110.476 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.606 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 12.8 m-85 -142.47 165.07 28.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 116.121 -0.49 . . . . 75.25 110.145 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG2' ' H ' ' A' ' 54' ' ' THR . 1.6 pm0 -82.12 -41.77 20.03 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.136 -0.938 . . . . 74.340000000000003 111.362 -171.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.435 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 65.4 p -100.92 149.16 24.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.99 -0.55 . . . . 75.450000000000003 109.739 178.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.485 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 13.2 pttm -68.07 -25.13 65.2 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.57 -0.53 . . . . 72.409999999999997 109.57 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -60.49 -49.77 76.22 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.536 -0.756 . . . . 73.420000000000002 110.574 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.516 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -81.08 -24.69 37.6 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.291 -0.413 . . . . 74.319999999999993 110.341 -178.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.485 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 11.7 ttt -71.8 -44.47 63.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.604 -0.725 . . . . 74.230000000000004 111.194 178.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.41 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 35.4 tt0 -62.68 -36.32 82.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 74.120000000000005 111.371 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.01 -15.03 63.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.152 0.501 . . . . 73.430000000000007 111.313 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.606 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 32.0 mmmt -99.13 1.58 45.17 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.178 -0.465 . . . . 75.319999999999993 111.054 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 0.2 OUTLIER -52.37 -48.52 65.53 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.457 0.473 . . . . 71.530000000000001 110.469 -176.465 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.592 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 14.3 tp60 -72.3 -28.74 63.28 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.223 -0.444 . . . . 75.219999999999999 110.588 -175.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -78.17 -37.06 46.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.852 -0.613 . . . . 74.349999999999994 111.378 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 21.7 ptp -79.71 -26.12 40.95 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.092 -0.707 . . . . 73.230000000000004 109.092 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.523 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 88.7 mtp -81.23 -13.22 58.75 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.398 -0.819 . . . . 73.209999999999994 111.53 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -65.33 -26.96 68.27 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 122.115 0.96 . . . . 73.430000000000007 108.793 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -102.78 16.0 27.75 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.113 -1.403 . . . . 74.540000000000006 111.564 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.604 ' O ' ' HE2' ' B' ' 237' ' ' MET . 22.7 m-30 -106.83 -45.74 4.12 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.985 -0.746 . . . . 74.420000000000002 108.985 172.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.552 ' HE1' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -65.38 -60.66 2.73 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.983 0.421 . . . . 72.239999999999995 110.876 174.604 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -73.84 -16.6 61.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.34 1.237 . . . . 72.409999999999997 114.34 -168.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -96.92 3.04 52.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 113.641 0.978 . . . . 73.540000000000006 113.641 -158.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.624 ' HB3' ' HE3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 7.42 11.51 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.652 -0.704 . . . . 74.010000000000005 109.203 167.623 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.701 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 2.6 pttm -78.78 -39.13 36.72 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.594 -0.73 . . . . 72.129999999999995 111.41 -172.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.48 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -70.23 -31.18 68.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.101 0.476 . . . . 70.329999999999998 110.04 -179.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.6 mtm -77.04 -27.97 54.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.68 -0.691 . . . . 74.430000000000007 110.038 176.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.742 HD13 ' HE3' ' B' ' 270' ' ' MET . 6.8 tt -70.51 -46.86 62.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 72.239999999999995 109.778 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.525 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -60.34 -32.23 71.05 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.054 -0.521 . . . . 75.129999999999995 110.765 176.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.6 -15.31 62.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.919 -0.582 . . . . 64.409999999999997 111.48 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -104.9 -10.26 17.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.812 0.339 . . . . 75.209999999999994 110.537 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.436 ' O ' HG13 ' A' ' 85' ' ' ILE . 17.0 mmt -68.97 -48.36 63.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 74.150000000000006 110.511 177.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.531 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 24.0 mm-40 -56.54 -30.28 62.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.686 -0.688 . . . . 73.200000000000003 111.743 -177.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -56.03 -25.76 46.04 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.039 0.447 . . . . 74.209999999999994 110.975 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -107.69 -32.25 7.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.17 -0.468 . . . . 74.329999999999998 110.879 177.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.647 HG12 ' HE3' ' B' ' 258' ' ' MET . 62.7 mt -70.61 -63.65 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 111.932 0.345 . . . . 75.549999999999997 111.932 -176.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.704 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 0.9 OUTLIER -76.81 -3.26 37.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.045 0.45 . . . . 73.099999999999994 111.268 -174.525 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -107.98 3.85 24.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.688 -0.687 . . . . 65.109999999999999 110.448 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -52.55 -52.84 52.95 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.293 -0.412 . . . . 74.400000000000006 110.936 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.118 -0.492 . . . . 71.430000000000007 110.753 -177.94 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.439 -0.578 . . . . 75.099999999999994 109.439 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -81.45 -90.58 0.07 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.899 0.381 . . . . 74.129999999999995 110.894 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -106.11 -26.14 11.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 75.319999999999993 110.679 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -100.23 162.35 13.02 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.117 -0.492 . . . . 72.209999999999994 111.161 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.402 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.2 OUTLIER -75.9 43.83 0.28 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.42 -0.809 . . . . 75.400000000000006 112.602 -176.714 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.402 ' CE2' ' HB1' ' B' ' 206' ' ' ALA . 70.9 m-85 -54.17 -41.64 68.74 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.837 0.351 . . . . 75.230000000000004 111.321 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.7 -19.8 63.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.837 -0.62 . . . . 63.409999999999997 112.035 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.4 HH12 HD13 ' A' ' 27' ' ' ILE . 49.2 mtm180 -92.9 -56.97 2.79 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.943 -0.303 . . . . 75.230000000000004 110.799 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.678 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -51.51 -27.37 10.47 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.539 0.57 . . . . 60.329999999999998 112.539 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.6 t -69.5 -20.95 63.71 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 121.058 -0.257 . . . . 74.019999999999996 111.363 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -81.12 -29.46 34.82 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.254 -0.647 . . . . 73.519999999999996 109.254 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.678 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.0 mm? -63.64 -46.54 85.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.975 -1.011 . . . . 72.030000000000001 108.96 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.541 HG22 ' HD2' ' A' ' 43' ' ' TYR . 74.6 mt -67.59 -32.66 57.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.404 -0.816 . . . . 74.140000000000001 110.253 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 2.1 tmmt? -60.39 -36.86 79.09 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.64 -0.709 . . . . 75.310000000000002 111.167 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.523 HD13 HD23 ' A' ' 14' ' ' LEU . 3.2 tm? -63.27 -41.18 99.0 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.787 -0.82 . . . . 72.430000000000007 108.787 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.11 -28.99 68.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 73.0 110.849 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.499 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 0.9 OUTLIER -64.35 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 73.140000000000001 111.036 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -66.82 -39.95 87.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 72.239999999999995 111.196 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.84 -22.2 53.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.446 0.641 . . . . 75.019999999999996 109.945 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.34 -3.31 52.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.167 -0.924 . . . . 64.319999999999993 110.419 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.487 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 52.0 mt-30 -78.93 -8.18 58.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.421 -0.354 . . . . 52.340000000000003 110.864 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.543 HD21 HG13 ' B' ' 227' ' ' ILE . 1.7 t30 -81.84 105.21 12.78 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.646 -0.501 . . . . 72.329999999999998 109.646 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.6 t -59.43 -32.34 70.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.305 0.854 . . . . 75.340000000000003 113.305 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . 0.485 ' HG2' ' ND2' ' B' ' 224' ' ' ASN . 12.4 pt-20 -79.01 -12.4 60.03 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.795 -0.362 . . . . 74.109999999999999 111.068 -175.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.543 HG13 HD21 ' B' ' 224' ' ' ASN . 10.0 mt -97.82 150.0 4.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.104 0.478 . . . . 73.420000000000002 109.966 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -85.87 150.7 24.34 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.814 -0.63 . . . . 71.430000000000007 109.752 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.3 m -57.53 -23.92 53.08 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.674 -0.694 . . . . 73.409999999999997 110.277 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -70.96 -25.62 75.44 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.348 -0.842 . . . . 55.039999999999999 113.692 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -76.64 -13.58 60.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 117.876 0.838 . . . . 74.319999999999993 110.392 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 12.6 t -90.96 -42.06 13.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.705 -0.68 . . . . 62.109999999999999 109.858 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 25.2 p -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.112 -0.494 . . . . 75.329999999999998 110.642 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.65 -33.1 74.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.124 -0.489 . . . . 60.140000000000001 110.693 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 38.7 m -67.68 -40.76 84.4 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.921 -0.4 . . . . 73.140000000000001 109.921 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.616 ' CD1' HD11 ' A' ' 14' ' ' LEU . 2.9 t80 -63.07 -35.63 80.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.539 0.685 . . . . 75.519999999999996 109.478 176.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.624 ' HE3' ' HB3' ' A' ' 73' ' ' TYR . 8.4 tpt -59.45 -60.74 3.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.796 -1.093 . . . . 75.230000000000004 110.808 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 25.3 t-105 -59.56 -36.26 75.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.228 -0.896 . . . . 74.540000000000006 111.532 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.402 ' HB2' HG13 ' A' ' 15' ' ' ILE . . . -64.41 -44.4 91.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.394 -0.366 . . . . 73.219999999999999 111.411 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.652 HD21 ' SD ' ' A' ' 37' ' ' MET . 43.5 tp -65.69 -33.94 77.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.4 . . . . 75.319999999999993 110.658 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.526 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.81 -43.6 97.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.95 -0.568 . . . . 60.32 110.924 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 68.6 mtm180 -70.95 -36.09 72.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 74.040000000000006 110.988 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -72.77 -39.17 66.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.336 -0.393 . . . . 74.329999999999998 110.725 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -72.69 -32.08 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.395 -0.366 . . . . 70.329999999999998 111.98 -177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -67.45 -14.74 63.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.971 0.415 . . . . 72.230000000000004 111.371 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 80.2 t90 -60.56 -38.68 85.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.052 -0.522 . . . . 64.450000000000003 110.962 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.516 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 62.0 m-85 -68.6 -13.92 62.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.288 0.477 . . . . 74.319999999999993 112.288 -175.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.512 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -61.44 -33.81 86.05 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.419 -0.896 . . . . 63.439999999999998 111.767 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 70.1 p -65.92 -23.75 66.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.807 0.336 . . . . 71.099999999999994 111.756 -176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 14.5 t -108.83 22.19 16.24 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.227 0.537 . . . . 75.140000000000001 110.444 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.4 t -87.13 -55.32 3.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.175 -0.466 . . . . 64.209999999999994 110.939 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.606 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -130.03 -179.65 5.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.083 0.468 . . . . 74.540000000000006 111.842 -177.313 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.413 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.2 pt-20 -89.87 -41.85 11.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.238 -0.892 . . . . 75.340000000000003 111.539 -173.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.413 HG23 ' HG3' ' B' ' 253' ' ' GLU . 81.9 p -117.31 151.92 35.97 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 110.026 -0.361 . . . . 75.25 110.026 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.704 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 12.7 ptmm? -65.77 -25.8 67.42 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.373 0.421 . . . . 73.420000000000002 110.441 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -56.19 -54.58 43.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 75.299999999999997 110.217 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.628 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 16.3 mt-30 -79.43 -36.3 39.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.582 -0.735 . . . . 74.420000000000002 110.03 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.647 ' HE3' HG12 ' A' ' 85' ' ' ILE . 12.0 ttt -59.93 -46.79 88.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.488 -0.778 . . . . 62.119999999999997 111.577 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.513 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 33.5 tt0 -65.3 -30.27 71.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.953 0.406 . . . . 72.420000000000002 110.96 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -77.55 -9.94 59.21 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.17 -0.468 . . . . 72.129999999999995 110.897 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.628 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.8 mmmt -104.14 -1.13 27.72 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 116.263 -0.426 . . . . 74.510000000000005 110.693 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' B' ' 259' ' ' GLN . 17.1 ptpt -57.5 -45.51 84.84 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.39 -0.368 . . . . 71.019999999999996 110.963 -174.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.5 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 12.2 tp60 -73.4 -19.56 60.96 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.058 -0.257 . . . . 75.209999999999994 110.924 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -83.26 -33.95 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 74.209999999999994 110.908 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' B' ' 262' ' ' LYS . 22.6 ptp -79.93 -26.99 39.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.962 -1.125 . . . . 72.049999999999997 107.962 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.525 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 73.1 mtp -89.92 23.86 2.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.55 -1.205 . . . . 74.030000000000001 110.168 174.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -104.28 -29.43 10.79 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.13 -1.063 . . . . 65.439999999999998 108.13 167.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.412 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.6 m-85 -98.21 9.24 43.43 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.685 -1.143 . . . . 62.109999999999999 112.039 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -94.71 -68.19 0.81 Allowed 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.543 -1.28 . . . . 74.140000000000001 107.543 166.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.742 ' HE3' HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -51.3 -61.29 2.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.134 -0.939 . . . . 74.510000000000005 110.756 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -85.15 19.4 2.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.288 -0.869 . . . . 70.340000000000003 112.483 -166.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.412 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 17.6 mmm180 -121.72 -30.7 4.11 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 121.346 -0.846 . . . . 72.439999999999998 112.564 -175.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.785 ' HB3' ' HE3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.75 1.37 43.11 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.533 -1.284 . . . . 64.430000000000007 107.533 172.14 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.552 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 73.5 tttt -58.76 -58.26 9.37 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 112.929 -1.941 . . . . 75.530000000000001 111.279 178.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -32.51 74.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.445 . . . . 72.409999999999997 111.284 -176.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 39.1 mtm -78.59 -21.97 47.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.203 0.525 . . . . 64.230000000000004 110.08 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.457 HD23 ' HG2' ' A' ' 66' ' ' MET . 5.6 tt -76.43 -47.14 24.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.665 -0.698 . . . . 71.219999999999999 110.004 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.426 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 36.1 t70 -67.15 -26.21 66.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.208 0.528 . . . . 63.539999999999999 110.416 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.01 66.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.603 -0.726 . . . . 71.439999999999998 110.777 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . 0.474 ' ND2' ' HG2' ' A' ' 42' ' ' ARG . 35.7 m-80 -89.17 -30.04 18.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.305 -0.407 . . . . 74.310000000000002 110.244 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.626 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -56.08 -58.77 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 75.140000000000001 110.184 176.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 14.9 mm-40 -51.71 -37.33 50.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.612 -0.722 . . . . 75.450000000000003 112.081 -178.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.27 -52.37 65.6 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.255 0.347 . . . . 70.5 110.65 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -70.42 -38.29 74.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.399 -0.364 . . . . 72.319999999999993 110.941 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.626 HG13 ' O ' ' B' ' 281' ' ' MET . 61.3 mt -59.9 -59.61 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 73.409999999999997 111.312 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 5.9 pt-20 -60.0 -29.72 68.66 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.906 0.384 . . . . 65.109999999999999 111.204 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -90.86 9.44 30.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.423 -0.353 . . . . 72.430000000000007 111.602 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.443 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 39.1 t80 -60.49 -45.33 94.16 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.805 -0.443 . . . . 75.319999999999993 109.805 173.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 . . . . . 0 N--CA 1.465 0.324 0 CA-C-N 115.929 -0.578 . . . . 74.140000000000001 110.616 176.585 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 6' ' ' ALA . 8.4 m120 . . . . . 0 N--CA 1.452 -0.331 0 N-CA-C 109.222 -0.658 . . . . 72.540000000000006 109.222 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -55.07 -73.09 0.06 Allowed 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.341 0.401 . . . . 71.549999999999997 111.402 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -133.22 -17.34 2.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.15 0.5 . . . . 74.209999999999994 110.694 177.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -107.48 163.27 13.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.96 -0.564 . . . . 73.219999999999999 111.674 -175.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.496 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -82.18 47.57 1.15 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.151 -0.931 . . . . 75.219999999999999 110.428 176.059 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -45.32 -52.09 10.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.032 -0.531 . . . . 75.209999999999994 111.492 -175.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.1 -34.93 74.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 73.129999999999995 111.972 -175.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -65.25 -54.05 35.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.374 -0.375 . . . . 75.129999999999995 110.497 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.673 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -74.19 -11.6 60.34 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.823 0.82 . . . . 65.25 110.265 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -70.23 -28.15 65.03 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.522 -1.217 . . . . 74.349999999999994 110.292 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.3 mm-40 -82.66 -27.3 31.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.48 0.657 . . . . 73.519999999999996 109.758 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.673 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -65.23 -49.89 67.94 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.081 -0.963 . . . . 64.530000000000001 109.446 176.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.493 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.1 mt -65.15 -30.17 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.796 -0.638 . . . . 74.129999999999995 110.201 175.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.662 ' HD3' HE22 ' A' ' 20' ' ' GLN . 5.3 tmtt? -57.98 -45.87 86.07 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.477 -0.783 . . . . 75.349999999999994 110.504 -179.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.466 HD11 HD12 ' B' ' 214' ' ' LEU . 1.8 tm? -56.04 -45.33 79.23 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.675 -0.491 . . . . 74.239999999999995 109.675 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.64 -28.43 65.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.688 -0.687 . . . . 71.439999999999998 111.287 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.61 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 23.4 m-80 -69.53 -26.89 64.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 71.219999999999999 111.374 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.662 HE22 ' HD3' ' A' ' 16' ' ' LYS . 2.6 mp0 -76.12 -30.54 58.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.246 0.546 . . . . 74.329999999999998 110.383 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -86.81 -16.98 34.57 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.89 -0.595 . . . . 64.239999999999995 110.007 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -84.57 -2.99 58.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.769 -0.65 . . . . 63.009999999999998 109.549 173.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.61 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 93.6 mt-30 -79.2 -2.16 39.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.807 -0.633 . . . . 74.030000000000001 109.718 173.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.577 HD21 HG13 ' A' ' 27' ' ' ILE . 2.3 t30 -74.84 106.85 6.57 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.1 -1.074 . . . . 71.129999999999995 108.1 172.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.2 t -53.53 -40.6 65.63 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 113.825 1.046 . . . . 73.040000000000006 113.825 -167.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -78.91 -21.01 47.98 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 112.36 0.504 . . . . 74.230000000000004 112.36 -176.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.577 HG13 HD21 ' A' ' 24' ' ' ASN . 11.1 mt -84.87 144.57 9.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.171 0.51 . . . . 75.209999999999994 110.139 -176.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.533 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -86.4 156.39 20.19 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.68 -0.691 . . . . 63.299999999999997 109.183 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.1 m -60.62 -30.55 69.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.292 0.567 . . . . 74.129999999999995 109.785 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.462 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -81.95 1.9 85.25 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.326 -0.852 . . . . 73.540000000000006 113.589 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.533 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 21.6 mm-40 -97.33 -19.46 18.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.85 0.825 . . . . 63.439999999999998 109.733 175.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.6 t -81.46 -25.92 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.739 -0.664 . . . . 72.120000000000005 110.169 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 p -59.9 -32.86 71.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.654 -0.703 . . . . 63.100000000000001 111.153 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.27 -34.3 75.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.187 -0.461 . . . . 72.519999999999996 110.71 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 m -69.26 -37.53 77.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 74.129999999999995 109.896 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.564 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 6.7 t80 -68.95 -35.16 76.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.743 -0.662 . . . . 74.109999999999999 109.644 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.779 ' HE2' HD21 ' B' ' 240' ' ' LEU . 3.9 ttm -70.7 -46.68 62.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.74 -0.664 . . . . 72.340000000000003 111.455 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -60.1 -39.57 86.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.108 0.48 . . . . 74.140000000000001 110.331 176.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.58 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.24 -39.7 93.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.895 -0.593 . . . . 74.120000000000005 111.115 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.76 HD23 ' SD ' ' B' ' 237' ' ' MET . 44.0 tp -65.04 -34.8 79.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.363 . . . . 74.120000000000005 110.475 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.99 -48.4 82.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.485 . . . . 65.340000000000003 110.75 177.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.426 ' HG2' ' OD1' ' B' ' 280' ' ' ASN . 20.7 mtm180 -68.81 -23.4 64.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 72.409999999999997 111.051 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' B' ' 233' ' ' SER . 15.3 t80 -83.7 -31.35 26.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 72.420000000000002 110.735 -178.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -79.42 -26.01 41.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.786 0.326 . . . . 65.109999999999999 111.179 179.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.477 ' HB1' HD23 ' B' ' 277' ' ' LEU . . . -87.55 13.07 10.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.351 0.596 . . . . 63.030000000000001 110.784 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -76.81 -13.86 59.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.485 -0.779 . . . . 75.540000000000006 110.409 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.15 -86.87 0.34 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.429 -0.582 . . . . 74.420000000000002 109.429 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.508 ' C ' ' HE3' ' A' ' 58' ' ' MET . . . 69.67 -60.43 0.69 Allowed Glycine 0 C--N 1.333 0.361 0 O-C-N 123.357 0.411 . . . . 64.439999999999998 112.915 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.413 ' N ' ' HE3' ' A' ' 58' ' ' MET . 11.4 p -75.47 -1.6 24.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.221 0.534 . . . . 72.109999999999999 110.958 -176.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 p -65.84 -31.87 73.07 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.544 . . . . 73.239999999999995 111.392 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -74.22 -45.79 45.94 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.927 -0.579 . . . . 74.420000000000002 111.486 -178.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.497 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 15.9 m-85 -153.09 167.4 29.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.49 0.662 . . . . 74.219999999999999 112.106 -173.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 54' ' ' THR . 1.8 pm0 -91.18 -51.41 5.33 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.353 -1.294 . . . . 74.400000000000006 111.402 -175.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.546 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 65.6 p -90.14 148.26 23.09 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 116.678 -0.237 . . . . 74.219999999999999 110.514 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.468 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 13.9 ptmm? -66.28 -26.21 67.23 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.337 -0.392 . . . . 72.519999999999996 110.478 -176.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -57.39 -42.81 82.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.766 -0.652 . . . . 75.519999999999996 111.049 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.452 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 11.5 mt-30 -93.92 -35.57 12.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.969 -0.56 . . . . 74.25 110.039 -177.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.508 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 15.6 ttt -62.01 -47.88 82.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.364 -0.835 . . . . 74.510000000000005 111.449 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.81 -30.59 71.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 74.540000000000006 111.05 -176.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.88 -5.35 43.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.113 -0.494 . . . . 75.010000000000005 111.446 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.768 ' HE3' ' HG2' ' A' ' 64' ' ' GLU . 28.9 mmmt -116.04 5.36 13.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.448 -0.342 . . . . 70.150000000000006 110.201 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.627 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 31.1 ttpt -57.58 -54.84 42.3 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.306 -0.406 . . . . 73.310000000000002 110.249 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -68.64 -27.92 66.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.37 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.768 ' HG2' ' HE3' ' A' ' 61' ' ' LYS . 5.5 tp10 -65.23 -45.28 85.3 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 116.033 -0.531 . . . . 74.25 110.857 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.636 ' HA ' ' HE1' ' A' ' 68' ' ' TYR . 20.5 ptp -77.75 -26.28 49.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.402 0.62 . . . . 75.329999999999998 109.375 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.731 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 65.6 mtp -80.94 -29.69 35.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.551 -0.75 . . . . 71.439999999999998 112.563 -177.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -64.22 -40.09 95.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.074 0.464 . . . . 75.329999999999998 110.725 -169.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.669 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 36.4 p90 -88.04 -12.15 45.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.931 -0.577 . . . . 71.239999999999995 110.493 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.425 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 2.3 m-30 -60.55 -44.7 95.83 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.229 -0.188 . . . . 75.340000000000003 110.623 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.668 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.55 -49.68 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.975 0.417 . . . . 75.219999999999999 110.05 173.679 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -85.19 47.91 1.49 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.605 0.717 . . . . 75.510000000000005 110.757 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.676 ' HB2' ' HE1' ' B' ' 237' ' ' MET . 1.9 mmp_? -113.06 -23.07 10.23 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 121.705 -0.622 . . . . 73.510000000000005 111.158 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 1.013 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 9.1 11.86 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.621 -0.432 . . . . 65.109999999999999 110.983 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.81 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 63.0 tttm -64.05 -59.16 4.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.485 -0.325 . . . . 73.439999999999998 110.531 -178.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -55.82 -37.83 69.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 74.239999999999995 111.321 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.8 mtt -61.79 -42.11 98.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.484 0.659 . . . . 73.349999999999994 110.332 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.637 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 2.0 tt -69.18 -36.28 77.16 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.229 -0.896 . . . . 75.439999999999998 109.304 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.412 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 12.1 t70 -61.45 -43.27 99.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.02 -0.991 . . . . 75.129999999999995 110.805 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.06 -14.28 62.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.514 -0.766 . . . . 73.540000000000006 111.814 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -99.55 -4.98 29.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.82 0.343 . . . . 72.239999999999995 111.004 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.418 ' HE1' ' CD2' ' A' ' 77' ' ' LEU . 19.0 mmt -80.73 -178.76 6.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.334 0.588 . . . . 72.409999999999997 111.569 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.69 ' HG2' HD11 ' A' ' 85' ' ' ILE . 3.8 mt-10 67.64 -2.33 1.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.641 -1.163 . . . . 74.409999999999997 114.059 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.96 -53.99 45.17 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.031 0.443 . . . . 55.130000000000003 109.95 177.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.418 ' HB2' ' HE3' ' B' ' 258' ' ' MET . 85.4 m-85 -85.4 -9.52 57.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 63.149999999999999 111.255 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.69 HD11 ' HG2' ' A' ' 82' ' ' GLU . 61.6 mt -79.34 -62.2 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.889 0.376 . . . . 73.310000000000002 110.897 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -66.8 -24.08 66.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.346 -0.388 . . . . 74.540000000000006 110.72 -176.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.402 ' ND2' ' HG3' ' A' ' 86' ' ' GLU . 47.8 m-80 -107.07 16.69 23.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.057 -0.52 . . . . 71.430000000000007 111.111 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.547 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 63.3 t80 -53.94 -49.41 68.75 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.556 0.206 . . . . 75.5 111.556 -177.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 C--N 1.327 -0.39 0 CA-C-O 121.067 0.46 . . . . 64.140000000000001 111.273 -179.692 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.417 ' N ' HD21 ' B' ' 203' ' ' ASN . 0.9 OUTLIER . . . . . 0 CA--C 1.519 -0.236 0 CA-C-O 120.896 0.379 . . . . 74.239999999999995 110.247 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -96.35 100.28 11.9 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.18 -0.464 . . . . 74.549999999999997 110.794 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.9 25.22 3.9 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.748 0.785 . . . . 74.540000000000006 109.14 172.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -152.75 -176.24 5.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 74.450000000000003 111.904 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -130.16 42.15 3.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 74.299999999999997 110.254 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -52.14 -41.05 62.21 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.642 -0.708 . . . . 74.519999999999996 111.843 -177.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.09 -20.7 64.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 71.040000000000006 111.431 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -85.36 -65.2 1.04 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.287 -0.415 . . . . 71.439999999999998 110.091 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.573 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -52.82 -25.98 13.11 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.432 0.901 . . . . 74.510000000000005 113.432 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.8 t -65.63 -28.04 68.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.632 0.253 . . . . 72.409999999999997 111.318 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.7 -18.71 39.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.221 0.534 . . . . 75.420000000000002 110.251 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -71.37 -46.19 61.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.566 -0.743 . . . . 72.5 109.461 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.58 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.8 mt -67.2 -30.79 50.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.427 0.632 . . . . 72.549999999999997 109.905 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -57.55 -39.96 77.84 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.188 -0.914 . . . . 75.430000000000007 111.084 -177.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.437 HD13 HD21 ' A' ' 14' ' ' LEU . 2.8 tm? -63.66 -42.6 98.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.354 -0.385 . . . . 73.019999999999996 110.052 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.41 -33.2 72.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 55.240000000000002 111.402 -177.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.79 -32.73 73.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.304 -0.407 . . . . 72.209999999999994 111.109 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -74.14 -28.22 61.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 72.439999999999998 111.264 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -85.18 -21.18 29.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.923 0.392 . . . . 74.510000000000005 110.519 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -78.13 -1.97 35.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.469 0.652 . . . . 75.219999999999999 109.854 175.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -79.45 -4.43 51.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.877 -0.601 . . . . 74.030000000000001 109.944 175.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.421 HD21 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -69.93 103.52 2.26 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.955 -0.758 . . . . 72.319999999999993 108.955 175.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.9 t -59.86 -26.51 65.91 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 113.287 0.847 . . . . 73.510000000000005 113.287 -171.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . 0.421 ' HG2' HD21 ' B' ' 224' ' ' ASN . 1.6 pm0 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.226 0.454 . . . . 75.209999999999994 112.226 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.416 HG13 HD21 ' B' ' 224' ' ' ASN . 4.2 mt -115.97 150.47 17.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.395 . . . . 74.150000000000006 110.943 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -88.76 166.35 14.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.094 -0.503 . . . . 74.230000000000004 109.783 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 10.4 m -67.22 -27.01 66.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.301 -0.409 . . . . 74.430000000000007 110.659 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -66.52 -27.44 73.16 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.938 -0.574 . . . . 73.299999999999997 113.322 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -74.4 -29.36 61.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.223 0.535 . . . . 73.340000000000003 109.778 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.8 t -76.29 -26.23 16.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 70.450000000000003 109.695 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 233' ' ' SER . . . . . 0.446 ' HA ' ' CE1' ' A' ' 43' ' ' TYR . 2.7 m -65.57 -24.68 67.15 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.819 -0.628 . . . . 75.420000000000002 109.75 174.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -85.51 -33.06 21.89 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.597 -0.729 . . . . 61.43 111.348 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.493 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 9.2 p -68.77 -34.36 75.44 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 120.7 -0.4 . . . . 72.209999999999994 110.41 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.652 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.3 t80 -67.18 -36.33 81.56 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.14 -0.689 . . . . 71.340000000000003 109.14 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 1.013 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.4 tpt -62.66 -57.5 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.142 -0.935 . . . . 75.239999999999995 110.554 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.496 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 31.1 t-105 -60.23 -35.62 75.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.455 -0.793 . . . . 74.510000000000005 111.643 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.494 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -62.65 -47.11 85.13 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.701 0.286 . . . . 71.400000000000006 110.945 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.779 HD21 ' HE2' ' A' ' 37' ' ' MET . 40.0 tp -62.83 -28.21 69.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 72.120000000000005 110.872 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -66.09 -49.44 67.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 72.239999999999995 110.908 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.6 mtm180 -68.76 -23.7 64.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.401 . . . . 64.420000000000002 110.862 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.493 ' HD2' HG23 ' A' ' 15' ' ' ILE . 13.7 t80 -78.9 -26.41 43.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.238 -0.437 . . . . 74.340000000000003 110.58 -179.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -90.61 -24.75 20.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.854 0.316 . . . . 74.430000000000007 111.854 -178.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . 0.476 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -83.66 2.3 38.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.532 0.682 . . . . 75.420000000000002 110.285 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -76.3 -9.21 58.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.803 -1.09 . . . . 72.099999999999994 109.929 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.543 ' HB3' ' OG1' ' B' ' 250' ' ' THR . 80.2 m-85 -95.94 -89.07 0.26 Allowed 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.912 -0.773 . . . . 75.319999999999993 108.912 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.561 ' C ' ' HE1' ' B' ' 258' ' ' MET . . . 64.63 -66.73 0.07 OUTLIER Glycine 0 C--N 1.334 0.437 0 O-C-N 123.663 0.602 . . . . 61.240000000000002 113.325 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 249' ' ' SER . . . . . 0.495 ' N ' ' HE1' ' B' ' 258' ' ' MET . 3.5 p -75.06 -3.34 31.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.107 0.48 . . . . 74.439999999999998 111.043 -175.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 250' ' ' THR . . . . . 0.543 ' OG1' ' HB3' ' B' ' 247' ' ' PHE . 24.1 p -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.948 -0.569 . . . . 75.299999999999997 111.038 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.2 t -86.4 -39.88 15.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.897 -0.592 . . . . 64.409999999999997 111.236 -177.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.528 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 4.0 m-85 -147.67 179.24 7.84 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.772 0.656 . . . . 75.219999999999999 112.772 -173.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.498 ' HG3' ' N ' ' B' ' 254' ' ' THR . 7.9 pt-20 -89.7 -50.98 5.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.035 -0.984 . . . . 71.530000000000001 111.334 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.53 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 68.9 p -107.33 159.44 16.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.071 -0.513 . . . . 72.219999999999999 111.063 -173.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.547 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 20.2 ptmt -67.28 -32.07 72.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.471 -0.331 . . . . 74.510000000000005 110.814 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . 0.53 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.7 mp0 -57.56 -42.73 83.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.167 0.508 . . . . 74.439999999999998 110.46 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 14.1 mt-30 -89.7 -34.97 16.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.677 -0.692 . . . . 75.109999999999999 110.266 -177.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.561 ' HE1' ' C ' ' B' ' 248' ' ' GLY . 14.8 ttt -63.5 -42.34 98.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.828 -0.624 . . . . 74.349999999999994 110.892 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.54 ' HG3' ' HE3' ' B' ' 262' ' ' LYS . 34.6 tt0 -62.64 -37.3 85.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 71.340000000000003 111.005 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.17 -9.0 50.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 52.420000000000002 111.159 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.528 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 30.9 mmmt -109.21 1.07 20.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.115 -0.493 . . . . 74.439999999999998 111.529 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.54 ' HE3' ' HG3' ' B' ' 259' ' ' GLN . 8.2 ptpp? -58.38 -39.74 80.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.711 0.291 . . . . 71.409999999999997 110.594 -175.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -90.1 -24.48 21.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 110.085 -0.339 . . . . 73.510000000000005 110.085 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . 0.404 ' HB2' ' HA ' ' B' ' 261' ' ' LYS . 45.8 mt-10 -75.17 -33.26 61.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 61.140000000000001 111.802 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.2 ptp -77.87 -30.42 50.82 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.073 -1.084 . . . . 72.109999999999999 108.073 175.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.637 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 45.2 mtp -87.33 16.47 5.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.981 -1.008 . . . . 73.019999999999996 110.703 177.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -91.79 -37.71 12.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.249 0.547 . . . . 74.540000000000006 110.072 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.505 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 13.9 p90 -109.06 -5.91 15.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.879 -0.6 . . . . 74.310000000000002 110.925 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -57.75 -48.01 80.86 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.634 0.254 . . . . 75.409999999999997 110.752 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.81 ' HE2' ' HA ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -57.71 -53.37 58.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.923 -0.581 . . . . 64.140000000000001 110.809 175.443 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.39 65.21 8.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.366 0.603 . . . . 74.420000000000002 111.444 -173.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.577 ' HB2' ' SD ' ' A' ' 37' ' ' MET . 85.2 mtm180 -125.63 -27.83 3.35 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.78 -0.645 . . . . 75.099999999999994 109.522 170.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.745 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -104.1 14.45 30.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.282 -0.417 . . . . 63.219999999999999 110.441 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -63.99 -58.76 5.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 75.25 109.828 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.51 -36.03 79.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 74.340000000000003 111.146 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 61.0 mtt -58.02 -46.77 84.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.316 0.579 . . . . 63.450000000000003 109.663 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.731 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 0.9 OUTLIER -67.02 -37.73 84.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.814 -1.085 . . . . 64.109999999999999 109.729 -177.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.498 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 13.8 t70 -64.06 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.499 -0.773 . . . . 75.120000000000005 110.092 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -72.37 -18.3 61.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.661 -0.7 . . . . 64.019999999999996 111.144 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . 0.426 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m120 -89.64 -20.07 24.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.066 0.46 . . . . 72.239999999999995 109.798 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.499 ' C ' ' H ' ' B' ' 283' ' ' ASP . 24.3 mmt -73.67 -165.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 74.299999999999997 110.172 173.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.588 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 6.5 mm-40 66.48 -34.59 0.21 Allowed 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.339 1.056 . . . . 75.010000000000005 112.989 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . 0.499 ' H ' ' C ' ' B' ' 281' ' ' MET . 18.2 t70 -47.9 -60.07 2.87 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.436 0.694 . . . . 73.450000000000003 112.236 -177.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -80.55 -13.33 59.16 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.213 -0.449 . . . . 75.439999999999998 110.808 -177.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.79 -53.61 13.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.116 -0.493 . . . . 73.319999999999993 110.307 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -63.15 -32.21 73.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.137 -0.483 . . . . 72.340000000000003 110.211 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -90.49 11.96 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.792 -0.64 . . . . 75.310000000000002 111.922 -176.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.411 ' CZ ' ' HA ' ' A' ' 54' ' ' THR . 38.3 t80 -58.18 -43.4 87.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.86 -0.793 . . . . 74.420000000000002 108.86 172.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.47 -0.786 . . . . 72.030000000000001 110.343 173.992 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.432 ' HA ' ' HD2' ' A' ' 8' ' ' TYR . 4.6 p-10 . . . . . 0 N--CA 1.448 -0.566 0 CA-C-O 121.783 0.801 . . . . 72.340000000000003 109.209 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -84.22 -72.25 0.47 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.313 -0.858 . . . . 73.430000000000007 112.212 -169.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -89.46 -15.11 33.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.295 0.569 . . . . 75.329999999999998 110.712 -171.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -139.13 167.11 22.8 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.944 -0.571 . . . . 75.230000000000004 111.615 -174.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.521 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.66 47.35 1.17 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.17 -0.923 . . . . 73.319999999999993 111.398 -179.171 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.432 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 68.7 m-85 -49.66 -42.22 44.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.378 . . . . 74.120000000000005 111.907 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.18 -18.8 64.7 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.194 0.442 . . . . 73.510000000000005 112.194 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -83.62 -53.92 5.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.527 0.203 . . . . 73.510000000000005 111.06 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.742 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -66.74 -17.04 64.66 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.89 0.853 . . . . 45.329999999999998 109.932 -176.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -55.53 -35.93 66.19 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.03 -1.441 . . . . 74.439999999999998 111.535 175.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.643 ' HB2' HD13 ' B' ' 217' ' ' LEU . 25.6 mt-10 -83.68 -24.82 31.13 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.125 0.488 . . . . 74.5 110.126 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.742 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -67.12 -44.55 79.61 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.66 -0.7 . . . . 75.340000000000003 109.9 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 67.5 mt -73.48 -22.98 19.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.811 -0.631 . . . . 75.439999999999998 110.357 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -62.04 -34.98 77.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.889 -0.596 . . . . 70.439999999999998 110.622 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.54 HD11 HD12 ' B' ' 214' ' ' LEU . 2.5 tm? -72.71 -39.72 66.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.476 -0.564 . . . . 73.329999999999998 109.476 176.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.86 95.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.222 0.534 . . . . 75.200000000000003 110.23 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.462 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 88.7 m-20 -65.26 -23.09 66.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.869 -0.605 . . . . 73.140000000000001 110.908 177.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -74.1 -35.8 64.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.102 0.477 . . . . 63.030000000000001 110.149 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -81.23 -23.57 37.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.267 0.556 . . . . 72.219999999999999 110.137 178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.63 9.37 7.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.495 0.664 . . . . 73.129999999999995 110.201 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 26.5 mt-30 -83.81 -5.99 59.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.944 -0.571 . . . . 74.319999999999993 110.34 175.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.494 HD21 HG13 ' A' ' 27' ' ' ILE . 1.1 t30 -78.36 109.81 12.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.762 . . . . 72.129999999999995 108.941 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.7 t -65.35 -30.2 71.02 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.916 0.71 . . . . 72.510000000000005 112.916 -170.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -86.12 -11.73 51.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.761 0.652 . . . . 72.040000000000006 112.761 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.494 HG13 HD21 ' A' ' 24' ' ' ASN . 11.0 mt -96.05 144.97 9.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.38 0.61 . . . . 70.420000000000002 110.401 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.478 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -79.7 153.64 29.15 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.272 -0.876 . . . . 75.450000000000003 109.703 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.4 m -62.63 -20.88 65.22 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.965 -0.561 . . . . 65.239999999999995 111.212 -177.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.72 -27.11 72.93 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.903 -0.59 . . . . 63.030000000000001 113.73 -177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.478 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 12.0 mm-40 -75.35 -18.96 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.525 0.663 . . . . 74.439999999999998 110.262 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -86.46 -43.35 16.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.66 -0.7 . . . . 65.0 110.249 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.7 p -61.59 -39.26 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.111 -0.495 . . . . 71.340000000000003 110.519 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.67 -33.06 75.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.912 -0.585 . . . . 71.239999999999995 111.11 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.3 m -69.49 -35.77 75.88 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 72.430000000000007 110.059 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.503 ' CD1' HD13 ' B' ' 214' ' ' LEU . 8.1 t80 -67.9 -34.65 77.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.32 0.581 . . . . 74.230000000000004 109.509 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.781 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 13.0 ttm -67.0 -51.24 57.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.465 -0.789 . . . . 74.5 111.54 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 30.1 t-105 -60.65 -37.1 80.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.851 0.357 . . . . 73.230000000000004 110.584 178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.483 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -65.56 -37.35 86.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 74.510000000000005 111.278 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.829 HD21 ' HE3' ' B' ' 237' ' ' MET . 47.3 tp -70.01 -32.51 70.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.05 0.452 . . . . 73.519999999999996 110.22 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.513 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.45 -42.05 98.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.663 -0.699 . . . . 73.150000000000006 110.845 178.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 42' ' ' ARG . 39.5 mtp180 -69.94 -37.31 75.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.096 0.474 . . . . 75.450000000000003 110.558 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -74.54 -34.81 63.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.789 -0.641 . . . . 72.519999999999996 111.405 -173.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.7 m-20 -74.61 -28.82 61.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.644 0.259 . . . . 73.450000000000003 111.495 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.6 -19.25 63.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.554 . . . . 75.340000000000003 111.055 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -61.9 -27.88 69.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.128 -0.942 . . . . 73.25 110.738 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.498 ' O ' HG22 ' A' ' 50' ' ' THR . 60.0 m-85 -90.41 10.36 25.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.367 -0.379 . . . . 70.319999999999993 111.718 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.488 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.41 -27.16 73.5 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.416 -0.897 . . . . 71.219999999999999 111.423 176.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.1 p -67.57 -27.97 67.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 72.430000000000007 111.313 -177.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.3 t -90.89 12.83 18.25 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.152 0.501 . . . . 71.340000000000003 110.729 -176.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.1 t -78.99 -65.64 0.97 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.248 -0.433 . . . . 65.099999999999994 111.534 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.713 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 5.8 m-85 -133.02 -176.05 3.99 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.559 0.578 . . . . 71.329999999999998 112.559 -172.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.484 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.1 pt-20 -92.62 -48.69 6.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.065 -0.97 . . . . 72.409999999999997 111.415 -172.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.484 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.3 p -105.25 156.59 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.244 -0.435 . . . . 63.140000000000001 110.065 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.494 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.8 ptmm? -70.52 -25.28 63.05 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.837 -0.345 . . . . 75.25 110.882 -175.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -72.05 -42.21 66.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.084 -0.246 . . . . 71.019999999999996 110.917 -178.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.752 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.6 mt-30 -74.15 -45.15 50.53 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 73.319999999999993 109.637 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.497 ' HE1' HG12 ' B' ' 285' ' ' ILE . 17.2 ttt -57.88 -40.68 80.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 72.120000000000005 111.684 -179.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.539 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.5 tt0 -63.53 -36.59 84.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.95 0.405 . . . . 74.420000000000002 111.14 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.77 9.37 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.127 -0.488 . . . . 74.129999999999995 111.12 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.752 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 71.5 mmtt -115.21 -1.99 12.82 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-N 116.223 -0.444 . . . . 74.430000000000007 110.241 -177.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 14.2 ptmt -54.38 -56.5 18.01 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.431 -0.804 . . . . 62.240000000000002 110.393 -178.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.467 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.0 tp60 -70.25 -23.17 62.85 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.775 -0.193 . . . . 73.209999999999994 110.627 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -71.17 -41.48 70.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.44 -0.345 . . . . 71.230000000000004 110.612 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.506 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 20.2 ptp -81.96 -25.44 34.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.487 0.661 . . . . 74.129999999999995 109.309 -179.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.685 ' HE3' ' HB3' ' B' ' 277' ' ' LEU . 69.3 mtp -82.03 -25.25 34.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.426 -0.806 . . . . 75.310000000000002 111.785 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 23.9 t70 -64.23 -33.09 75.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.965 0.412 . . . . 74.329999999999998 110.582 -169.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -98.01 -14.28 20.64 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.021 -0.536 . . . . 74.400000000000006 110.548 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.446 ' HB2' ' HA ' ' A' ' 66' ' ' MET . 1.0 OUTLIER -57.66 -53.3 59.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 110.08 -0.341 . . . . 65.530000000000001 110.08 174.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.774 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -46.98 -58.53 3.87 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.615 -0.72 . . . . 73.430000000000007 110.879 174.877 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.588 ' OD1' ' HG2' ' B' ' 270' ' ' MET . 5.7 t0 -91.96 28.44 1.84 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.867 -0.606 . . . . 73.319999999999993 111.605 -169.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 4.6 mtp180 -84.45 -42.39 15.67 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.043 0.449 . . . . 75.319999999999993 110.555 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.722 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.0 OUTLIER -87.78 19.58 3.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.258 0.551 . . . . 75.439999999999998 109.686 -178.445 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.577 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 25.2 tttp -57.11 -66.0 0.53 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.039 -0.982 . . . . 75.430000000000007 110.732 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -64.41 -27.23 68.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 74.239999999999995 110.949 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.4 mtt -66.3 -38.02 86.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.484 0.659 . . . . 74.319999999999993 110.067 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.563 HD21 ' HG2' ' B' ' 266' ' ' MET . 5.4 tt -76.83 -37.37 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.246 -0.888 . . . . 73.209999999999994 109.811 -178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.785 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 13.2 t70 -59.55 -41.19 89.56 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.962 -0.563 . . . . 74.409999999999997 110.421 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.24 -5.63 33.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.287 -0.87 . . . . 71.519999999999996 111.83 -177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -105.67 -4.44 21.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.954 -0.298 . . . . 75.109999999999999 111.205 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.546 ' HE3' ' CD2' ' A' ' 77' ' ' LEU . 51.7 mtt -95.86 -172.87 2.69 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.842 0.353 . . . . 74.120000000000005 110.839 175.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.665 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 36.3 mt-10 67.12 -6.5 0.58 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.021 0.928 . . . . 74.329999999999998 113.466 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.56 -54.91 38.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.74 0.305 . . . . 63.299999999999997 110.783 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -9.12 49.03 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 120.959 0.409 . . . . 72.409999999999997 110.179 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.665 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -70.43 -57.03 8.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.869 0.366 . . . . 72.510000000000005 110.077 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -68.45 -17.95 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 73.439999999999998 110.733 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -109.32 14.56 23.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 72.310000000000002 111.487 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -58.68 -51.82 68.32 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.73 0.3 . . . . 74.510000000000005 110.296 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 116.097 -0.501 . . . . 73.329999999999998 110.273 178.269 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 109.71 -0.478 . . . . 74.120000000000005 109.71 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -78.34 -81.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.57 -0.286 . . . . 75.120000000000005 110.479 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -112.23 -47.06 3.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.896 0.379 . . . . 73.049999999999997 110.623 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -80.26 155.84 27.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.031 0.443 . . . . 75.409999999999997 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.11 51.93 0.7 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.379 -0.828 . . . . 73.519999999999996 112.602 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -56.99 -32.96 66.63 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.976 0.362 . . . . 71.319999999999993 111.976 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -81.1 -7.72 59.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.888 0.329 . . . . 75.010000000000005 111.888 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -94.1 -62.5 1.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.371 -0.233 . . . . 75.319999999999993 110.371 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.677 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.75 -26.34 13.86 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.844 0.683 . . . . 60.130000000000003 112.844 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.01 -18.5 65.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.187 -0.205 . . . . 75.329999999999998 111.534 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.51 -25.61 22.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.296 0.569 . . . . 72.340000000000003 109.573 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.677 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.64 -47.32 69.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 73.209999999999994 109.475 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.483 HG13 ' HB2' ' A' ' 39' ' ' ALA . 71.1 mt -66.56 -29.96 48.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.47 -0.786 . . . . 71.510000000000005 110.667 178.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -59.14 -36.51 75.36 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.925 -0.58 . . . . 74.099999999999994 110.758 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.643 HD13 ' HB2' ' A' ' 13' ' ' GLU . 2.5 tm? -68.65 -43.75 75.59 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.432 -0.581 . . . . 70.340000000000003 109.432 178.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.2 -40.9 91.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 74.409999999999997 110.613 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.561 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 84.8 m-20 -60.36 -30.85 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 71.319999999999993 111.199 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -30.05 62.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.338 . . . . 73.010000000000005 111.18 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -84.26 -24.33 29.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.584 0.707 . . . . 73.549999999999997 109.804 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.63 -9.47 58.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.881 -1.054 . . . . 72.409999999999997 110.127 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 25.4 mt-30 -76.99 -6.96 54.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.729 -0.669 . . . . 72.329999999999998 111.252 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.578 HD21 HG13 ' B' ' 227' ' ' ILE . 1.6 t30 -72.77 111.86 8.29 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.603 -0.517 . . . . 74.040000000000006 109.603 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 1.8 t -61.78 -35.51 78.36 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.142 0.793 . . . . 72.450000000000003 113.142 -171.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.57 -1.22 57.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.589 0.589 . . . . 73.219999999999999 112.589 -176.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.578 HG13 HD21 ' B' ' 224' ' ' ASN . 7.0 mt -107.69 153.19 9.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 C-N-CA 120.621 -0.432 . . . . 72.439999999999998 110.125 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.65 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 10.4 pt20 -91.99 159.04 15.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.592 -0.521 . . . . 75.25 109.592 177.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 1.1 m -59.67 -26.56 65.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.253 -0.43 . . . . 75.109999999999999 111.141 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -65.84 -26.36 72.15 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.629 -0.714 . . . . 63.25 113.695 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.65 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 5.7 mm-40 -78.8 -24.53 44.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.387 0.593 . . . . 72.420000000000002 109.615 -178.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 26.3 t -82.24 -41.84 18.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.44 -0.8 . . . . 63.43 110.092 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 13.3 p -62.3 -37.35 85.23 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.112 -0.494 . . . . 72.329999999999998 110.121 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.04 76.63 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.889 -0.596 . . . . 74.450000000000003 110.882 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.521 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 42.3 m -68.41 -35.65 77.97 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.855 0.359 . . . . 73.099999999999994 110.045 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.556 ' CD1' HD13 ' A' ' 14' ' ' LEU . 2.7 t80 -67.55 -38.01 83.51 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.294 -0.632 . . . . 75.040000000000006 109.294 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.829 ' HE3' HD21 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -62.13 -53.05 60.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.097 -0.956 . . . . 74.209999999999994 110.948 176.919 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -61.81 -38.67 89.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.125 -0.489 . . . . 74.109999999999999 111.114 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.634 ' HB3' ' HB1' ' A' ' 11' ' ' ALA . . . -64.37 -41.34 96.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.376 -0.374 . . . . 72.310000000000002 111.423 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.98 -34.39 78.31 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 120.666 0.27 . . . . 75.109999999999999 110.371 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.467 ' HB3' ' HB2' ' A' ' 73' ' ' TYR . . . -62.47 -39.14 92.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.367 -0.379 . . . . 74.519999999999996 111.104 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -73.3 -34.94 66.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.146 0.498 . . . . 65.439999999999998 110.339 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -80.94 -30.4 35.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.604 -0.725 . . . . 74.510000000000005 110.585 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . 0.434 ' HB3' HD12 ' A' ' 77' ' ' LEU . 10.7 t-20 -77.46 -40.59 42.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 72.120000000000005 110.824 -178.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -62.35 -17.82 59.9 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.098 0.475 . . . . 75.439999999999998 111.274 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -59.32 -26.87 65.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.284 -0.871 . . . . 75.329999999999998 111.307 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.434 ' O ' HG21 ' B' ' 250' ' ' THR . 67.4 m-85 -89.6 1.36 56.09 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.373 -0.376 . . . . 75.400000000000006 111.511 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.481 ' C ' ' HE2' ' B' ' 258' ' ' MET . . . -63.72 -29.47 74.83 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.067 -1.063 . . . . 72.310000000000002 111.144 175.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 22.5 m -71.15 -6.97 43.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.102 0.408 . . . . 73.409999999999997 112.102 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 250' ' ' THR . . . . . 0.434 HG21 ' O ' ' B' ' 247' ' ' PHE . 12.8 t -115.6 16.99 16.46 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.0 0.429 . . . . 72.109999999999999 110.623 176.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.2 t -83.97 -59.16 2.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.346 -0.388 . . . . 74.420000000000002 110.876 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.71 ' CE2' ' HG2' ' B' ' 261' ' ' LYS . 1.6 m-85 -126.96 172.97 9.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.618 0.247 . . . . 72.200000000000003 111.006 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -94.1 -42.55 8.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.053 -0.522 . . . . 70.400000000000006 111.727 -173.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 50.7 p -100.16 154.12 18.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.508 -0.315 . . . . 71.540000000000006 110.39 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -65.1 -30.75 71.71 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.9 -0.32 . . . . 71.140000000000001 110.595 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -66.85 -45.93 76.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.014 0.435 . . . . 73.409999999999997 110.88 -178.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.566 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 22.8 mt-30 -80.19 -24.77 40.08 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.147 -0.479 . . . . 73.409999999999997 110.768 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.481 ' HE2' ' C ' ' B' ' 248' ' ' GLY . 20.3 ttt -76.34 -39.24 54.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.459 . . . . 71.519999999999996 110.214 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.554 ' HB2' HG23 ' A' ' 85' ' ' ILE . 33.0 tt0 -67.8 -49.01 64.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.611 . . . . 71.409999999999997 111.651 -177.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.26 66.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.128 0.49 . . . . 75.510000000000005 110.641 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.71 ' HG2' ' CE2' ' B' ' 252' ' ' PHE . 13.6 mptt -95.89 8.67 42.98 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.47 -0.787 . . . . 73.0 111.487 -175.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.624 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 15.2 ptpt -52.82 -45.74 67.43 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.309 -0.626 . . . . 74.540000000000006 109.309 175.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.624 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 10.2 tp60 -75.0 -24.07 58.34 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.99 -0.55 . . . . 73.540000000000006 110.858 -175.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.25 -46.31 74.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.571 0.224 . . . . 74.340000000000003 110.936 178.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.567 ' HE1' ' HA ' ' B' ' 262' ' ' LYS . 2.7 ptt? -78.4 -33.21 48.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.279 -0.568 . . . . 71.439999999999998 109.736 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.785 ' HE3' ' HB2' ' A' ' 78' ' ' ASP . 45.8 mtp -83.13 21.65 1.06 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.796 -0.638 . . . . 64.040000000000006 111.0 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 34.7 t70 -109.45 -25.08 10.69 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.659 -0.497 . . . . 62.130000000000003 109.659 174.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.465 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 18.3 p90 -113.81 -20.62 11.05 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.423 -0.511 . . . . 70.140000000000001 111.651 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -54.63 -48.24 72.5 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.097 0.475 . . . . 73.25 110.388 177.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.588 ' HG2' ' OD1' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -53.88 -47.67 70.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.238 -0.892 . . . . 65.420000000000002 110.584 175.568 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . 0.457 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 5.4 t70 -78.89 7.11 7.68 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.485 -1.234 . . . . 74.549999999999997 111.801 -170.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.465 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 6.9 mtp180 -84.02 -26.42 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.918 -0.489 . . . . 71.25 111.669 -171.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.781 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -106.9 15.07 25.84 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.707 -0.397 . . . . 75.439999999999998 110.258 179.15 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.427 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 26.3 ttmt -60.78 -53.82 52.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.96 -0.563 . . . . 75.209999999999994 110.71 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -64.31 -36.4 84.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.966 0.412 . . . . 72.129999999999995 110.801 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.4 mtt -58.91 -43.75 91.12 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 74.319999999999993 110.031 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.685 ' HB3' ' HE3' ' A' ' 66' ' ' MET . 1.3 tt -72.4 -39.1 68.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.303 -0.862 . . . . 72.0 109.753 -178.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.628 ' HB2' ' HE2' ' A' ' 66' ' ' MET . 20.6 t70 -62.19 -34.84 77.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.403 -0.817 . . . . 71.109999999999999 111.005 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -83.5 -6.94 59.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.594 -0.73 . . . . 74.129999999999995 111.913 -178.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -104.2 -3.77 23.95 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.571 -0.452 . . . . 75.409999999999997 111.24 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.483 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 42.0 mtt -89.82 -167.04 1.74 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.234 -0.439 . . . . 74.150000000000006 111.293 176.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.4 mt-10 70.29 -12.25 0.52 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.057 -0.974 . . . . 75.409999999999997 113.376 176.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -57.97 -57.76 11.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.051 0.453 . . . . 71.239999999999995 110.129 175.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -72.58 -16.24 61.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.043 -0.526 . . . . 65.510000000000005 111.475 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.558 HD11 ' HA ' ' B' ' 282' ' ' GLU . 56.1 mt -76.55 -56.98 6.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.488 -0.323 . . . . 75.129999999999995 110.234 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.3 pt-20 -62.18 -34.19 75.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 72.099999999999994 110.775 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -87.99 6.56 35.37 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.344 -0.389 . . . . 71.540000000000006 111.724 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.494 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 44.2 t80 -56.43 -47.76 78.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.321 -0.622 . . . . 64.420000000000002 109.321 174.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 14.6 t70 . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 115.748 -0.66 . . . . 73.209999999999994 110.407 176.11 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.9 p-10 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 109.81 -0.441 . . . . 75.430000000000007 109.81 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.582 ' HB3' ' HE2' ' A' ' 8' ' ' TYR . 37.5 tt0 -65.8 -81.12 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.234 -0.439 . . . . 74.209999999999994 111.19 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -124.14 -27.56 3.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.175 0.512 . . . . 73.120000000000005 110.24 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -106.38 167.86 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.004 -0.544 . . . . 71.540000000000006 111.329 -175.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.468 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -78.7 47.18 0.71 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.427 -0.806 . . . . 74.209999999999994 111.643 -178.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.582 ' HE2' ' HB3' ' A' ' 4' ' ' GLU . 75.2 m-85 -49.37 -48.54 46.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 73.310000000000002 111.591 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -26.27 67.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.041 -0.527 . . . . 74.219999999999999 112.2 -175.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.472 ' HD3' ' HA ' ' A' ' 10' ' ' ARG . 27.1 mmt180 -81.39 -51.49 8.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.269 -0.172 . . . . 71.109999999999999 111.404 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.628 ' HB1' ' HB3' ' B' ' 239' ' ' ALA . . . -63.6 -23.5 67.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.874 0.845 . . . . 70.439999999999998 109.701 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -58.63 -33.47 70.08 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.124 -1.398 . . . . 72.310000000000002 111.22 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.546 ' HB2' HD11 ' B' ' 217' ' ' LEU . 28.1 mt-10 -79.15 -31.9 44.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.374 0.607 . . . . 75.409999999999997 109.469 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.627 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -63.01 -43.46 98.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.019 -0.991 . . . . 75.25 109.533 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.662 HG21 ' HD2' ' B' ' 243' ' ' TYR . 84.9 mt -69.91 -33.09 54.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.348 -0.842 . . . . 72.450000000000003 110.598 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -31.14 71.19 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.9 -0.591 . . . . 74.549999999999997 111.055 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.498 HD11 HD22 ' B' ' 214' ' ' LEU . 2.8 tm? -69.71 -45.92 67.12 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.05 -0.722 . . . . 75.439999999999998 109.05 176.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.77 -39.27 84.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.968 -0.56 . . . . 72.329999999999998 110.808 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.91 -21.47 66.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.281 -0.418 . . . . 72.430000000000007 111.396 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -33.95 34.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.012 0.435 . . . . 72.5 109.865 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -78.69 -24.3 45.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.245 0.545 . . . . 75.430000000000007 110.025 177.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.461 ' OD1' HG22 ' A' ' 29' ' ' THR . 0.2 OUTLIER -70.49 -10.91 60.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.49 -0.777 . . . . 71.120000000000005 109.577 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -78.83 -9.75 59.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.584 -0.734 . . . . 75.120000000000005 110.737 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.42 HD21 HG13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -70.43 159.64 33.84 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.154 0.502 . . . . 75.450000000000003 110.977 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.6 t -121.37 -16.57 7.84 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.469 -0.787 . . . . 72.099999999999994 110.239 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.74 3.71 49.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.515 -0.766 . . . . 74.0 111.021 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.74 HG21 ' H ' ' A' ' 28' ' ' GLN . 1.6 mt -128.25 -174.72 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.129999999999995 109.742 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.832 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 41.5 mt-30 -120.4 160.57 22.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.389 -0.597 . . . . 73.340000000000003 109.389 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.536 HG23 ' CZ ' ' B' ' 247' ' ' PHE . 58.6 m -64.01 -38.56 91.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.024 0.44 . . . . 73.450000000000003 110.802 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.56 74.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.086 -0.578 . . . . 74.439999999999998 112.979 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.832 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 8.5 mm-40 -68.99 -35.76 77.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.312 0.577 . . . . 72.200000000000003 109.596 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.4 HG22 ' HA ' ' A' ' 22' ' ' ASN . 47.8 t -63.84 -43.97 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.176 -0.92 . . . . 71.400000000000006 109.819 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.1 t -61.08 -42.93 99.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.719 -0.673 . . . . 73.400000000000006 110.438 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.888 -0.596 . . . . 61.340000000000003 111.279 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.509 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 16.2 m -66.71 -33.13 74.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.775 -0.454 . . . . 74.340000000000003 109.775 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.633 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.0 t80 -67.11 -41.09 86.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.3 0.572 . . . . 73.549999999999997 109.538 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.692 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.0 ttm -64.65 -48.47 74.7 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.51 -0.768 . . . . 75.420000000000002 111.427 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.52 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 27.4 t-105 -64.21 -37.15 86.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.387 . . . . 74.340000000000003 110.916 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.562 ' HB2' ' HB3' ' B' ' 211' ' ' ALA . . . -65.44 -36.38 83.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.962 0.41 . . . . 74.439999999999998 110.657 178.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.742 HD23 ' SD ' ' B' ' 237' ' ' MET . 58.6 tp -68.52 -36.96 79.58 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 74.420000000000002 109.703 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -33.25 71.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.644 -0.707 . . . . 65.310000000000002 111.076 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -78.5 -52.51 8.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.13 -0.486 . . . . 74.430000000000007 110.733 178.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.44 ' HD2' HG22 ' B' ' 215' ' ' ILE . 20.2 t80 -65.42 -42.28 92.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.39 -0.823 . . . . 74.230000000000004 111.549 -173.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -80.24 -25.14 39.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.405 -0.362 . . . . 64.519999999999996 111.652 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.586 ' HB3' ' HG ' ' B' ' 277' ' ' LEU . . . -81.28 -21.03 39.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.081 0.467 . . . . 75.109999999999999 110.54 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.43 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 11.3 t90 -56.63 -32.92 65.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 71.129999999999995 110.553 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -72.51 -9.0 58.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 71.200000000000003 111.532 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.605 ' O ' ' HE1' ' A' ' 58' ' ' MET . . . -67.79 -30.92 74.86 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.468 -0.872 . . . . 70.129999999999995 111.066 174.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 t -71.62 -2.96 18.99 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.747 0.308 . . . . 53.329999999999998 111.212 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -127.25 16.18 7.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.194 0.521 . . . . 72.329999999999998 109.978 174.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.5 t -74.17 -47.9 32.74 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.943 -0.571 . . . . 75.010000000000005 111.203 -175.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.623 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -134.03 -176.09 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.126 0.489 . . . . 74.209999999999994 112.078 -176.48 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.623 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.2 pt-20 -97.63 -25.59 15.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.133 -0.939 . . . . 75.510000000000005 111.881 -171.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.534 ' HA ' ' CE2' ' B' ' 288' ' ' PHE . 67.7 p -135.92 157.76 46.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.199 -0.455 . . . . 73.510000000000005 109.785 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 9.8 ptmm? -71.64 -30.59 65.93 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.547 -0.461 . . . . 72.040000000000006 110.322 -177.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.74 -38.78 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 73.420000000000002 110.414 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.683 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 23.0 mt-30 -88.05 -38.14 15.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.74 -0.664 . . . . 70.409999999999997 110.265 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.605 ' HE1' ' O ' ' A' ' 48' ' ' GLY . 14.5 ttt -60.07 -40.86 91.01 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.144 0.497 . . . . 72.519999999999996 111.182 178.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -63.37 -31.39 72.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.607 -0.724 . . . . 74.239999999999995 110.823 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.78 1.89 47.79 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.044 -0.525 . . . . 64.310000000000002 111.07 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -111.9 -0.99 15.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.092 -0.504 . . . . 74.239999999999995 109.715 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -51.39 -62.7 1.46 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.413 -0.812 . . . . 72.530000000000001 110.285 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -75.64 -11.92 60.1 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.548 -0.751 . . . . 74.409999999999997 110.471 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.42 -49.89 17.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.668 . . . . 73.120000000000005 110.767 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.2 ptt? -79.76 -26.7 40.61 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.253 0.549 . . . . 75.430000000000007 109.846 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.592 ' HE2' ' HB2' ' B' ' 278' ' ' ASP . 92.4 mtp -79.14 -2.12 39.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.641 -0.709 . . . . 72.129999999999995 110.522 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -74.47 -27.57 60.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.418 -0.956 . . . . 73.019999999999996 108.418 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 26.5 m-85 -102.82 -30.12 11.04 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.111 -1.404 . . . . 75.349999999999994 111.995 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -56.28 -58.31 8.52 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.011 -0.737 . . . . 73.219999999999999 109.011 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.507 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -56.9 -59.53 4.9 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.499 -0.318 . . . . 75.120000000000005 110.992 173.31 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -107.42 75.59 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.703 0.631 . . . . 75.530000000000001 112.703 -170.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' A' ' 68' ' ' TYR . 2.1 mmm180 -140.52 -29.95 0.67 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.841 -0.618 . . . . 74.430000000000007 110.323 166.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.639 ' HH ' ' HB3' ' B' ' 269' ' ' TYR . 0.1 OUTLIER -86.05 7.42 24.69 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.727 -0.842 . . . . 72.430000000000007 108.727 177.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.702 ' HA ' ' HE1' ' B' ' 270' ' ' MET . 11.9 tttp -59.59 -60.22 4.19 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.732 -1.122 . . . . 62.109999999999999 110.417 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.31 -32.39 73.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.89 -0.595 . . . . 73.010000000000005 111.517 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.465 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 53.0 mtt -59.76 -48.92 79.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.556 0.693 . . . . 74.430000000000007 109.321 172.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.707 HD23 ' HD2' ' B' ' 269' ' ' TYR . 17.6 tp -63.32 -38.27 90.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.416 -1.266 . . . . 74.120000000000005 110.628 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.605 ' HB2' ' HE2' ' B' ' 266' ' ' MET . 10.4 t70 -63.19 -53.93 45.48 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.771 -0.65 . . . . 72.319999999999993 110.199 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.12 -12.92 61.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.064 -0.971 . . . . 71.150000000000006 111.604 -178.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.0 -10.26 39.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.383 -0.371 . . . . 74.439999999999998 110.939 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.456 ' O ' HG13 ' A' ' 85' ' ' ILE . 63.4 mtt -101.12 -55.28 2.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 72.209999999999994 111.246 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.568 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 11.5 pt-20 -68.64 -14.89 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.852 0.686 . . . . 73.450000000000003 112.852 -169.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.09 -33.27 70.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.445 -0.576 . . . . 63.439999999999998 109.445 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -77.23 -38.41 51.28 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.859 -0.61 . . . . 75.340000000000003 110.215 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.703 HG12 ' HE3' ' B' ' 258' ' ' MET . 68.1 mt -59.22 -54.84 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.854 -0.612 . . . . 72.409999999999997 110.932 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.802 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 8.4 pt-20 -58.82 -33.87 70.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.454 -0.339 . . . . 74.200000000000003 111.559 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -94.24 17.51 12.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.681 -0.236 . . . . 71.040000000000006 111.497 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.487 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 22.2 t80 -53.14 -51.69 61.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.707 -0.224 . . . . 74.409999999999997 110.996 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.246 -0.434 . . . . 75.140000000000001 111.27 -179.587 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.524 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.3 p-10 . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 109.053 -0.721 . . . . 74.430000000000007 109.053 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.46 -92.51 0.12 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.88 0.371 . . . . 73.519999999999996 110.975 -176.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -95.4 -28.75 14.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.437 0.637 . . . . 73.319999999999993 109.483 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.524 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -103.87 160.58 14.68 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.26 -0.882 . . . . 70.409999999999997 110.882 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.52 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.2 OUTLIER -82.06 48.34 1.23 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.978 -1.01 . . . . 65.299999999999997 111.617 -177.641 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.488 ' HD2' ' HA ' ' B' ' 203' ' ' ASN . 53.7 m-85 -46.98 -53.55 12.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.242 -0.435 . . . . 75.099999999999994 111.921 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -58.88 -36.4 74.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.897 -0.592 . . . . 74.329999999999998 112.247 -176.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.472 ' O ' HD21 ' B' ' 214' ' ' LEU . 35.7 mmt180 -71.63 -48.94 44.58 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 111.75 0.278 . . . . 70.439999999999998 111.75 -176.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.562 ' HB3' ' HB2' ' A' ' 39' ' ' ALA . . . -63.88 -26.54 68.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.951 0.882 . . . . 75.430000000000007 109.585 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 212' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 3.1 m -62.54 -32.73 73.73 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.254 -1.339 . . . . 71.349999999999994 111.611 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.438 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 32.8 mt-10 -75.35 -28.75 59.71 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.553 0.692 . . . . 74.120000000000005 109.247 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.633 HD12 ' CD1' ' A' ' 36' ' ' PHE . 3.4 mm? -65.37 -44.39 87.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.996 -1.002 . . . . 75.329999999999998 109.578 176.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.44 HG22 ' HD2' ' A' ' 43' ' ' TYR . 75.2 mt -69.15 -27.93 36.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.441 -0.799 . . . . 73.150000000000006 110.389 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.438 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 14.2 tmtt? -60.15 -35.09 74.53 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.079 -0.51 . . . . 64.329999999999998 110.931 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.546 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.0 tm? -69.77 -42.25 74.07 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.968 -0.753 . . . . 74.129999999999995 108.968 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.33 84.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.84 -0.618 . . . . 74.010000000000005 110.797 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 93.6 m-20 -60.61 -26.11 66.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 72.219999999999999 111.165 179.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -31.85 43.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.594 -0.276 . . . . 72.439999999999998 111.2 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -80.69 -28.06 36.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.479 0.656 . . . . 72.519999999999996 110.594 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -75.44 -1.47 24.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.185 -0.916 . . . . 75.120000000000005 110.672 -178.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.9 mm-40 -79.28 -0.56 32.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.06 -0.518 . . . . 73.310000000000002 111.613 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.992 HD21 HG13 ' B' ' 227' ' ' ILE . 43.2 t30 -80.06 164.9 23.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.015 0.436 . . . . 72.209999999999994 110.49 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 1.5 t -96.18 -40.11 9.35 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.82 -0.627 . . . . 50.420000000000002 112.468 -173.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.16 3.18 43.64 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 112.91 0.707 . . . . 75.239999999999995 112.91 -175.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.992 HG13 HD21 ' B' ' 224' ' ' ASN . 12.7 mt -94.88 147.41 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 C-N-CA 120.192 -0.603 . . . . 75.219999999999999 109.565 175.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.56 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 37.2 mt-30 -84.01 147.37 27.46 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.569 -0.741 . . . . 73.409999999999997 109.365 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 7.8 m -57.3 -27.43 62.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.277 0.561 . . . . 71.349999999999994 110.282 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -76.65 -21.16 75.4 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.577 -0.738 . . . . 62.100000000000001 113.41 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.56 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 12.4 mm-40 -72.29 -30.98 65.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.64 0.72 . . . . 60.420000000000002 110.088 -176.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.3 t -69.73 -39.85 78.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.293 -0.867 . . . . 73.019999999999996 109.502 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.9 t -62.56 -38.49 90.29 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.78 -0.645 . . . . 73.200000000000003 109.744 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.27 -36.33 82.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.949 -0.568 . . . . 72.310000000000002 110.796 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.468 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.2 m -66.44 -35.21 79.74 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.686 -0.487 . . . . 73.129999999999995 109.686 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.542 ' CD1' HD11 ' A' ' 14' ' ' LEU . 2.0 t80 -66.96 -37.57 84.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.774 -0.648 . . . . 74.549999999999997 109.655 176.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.742 ' SD ' HD23 ' A' ' 40' ' ' LEU . 8.6 tpt -63.64 -52.45 60.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 75.340000000000003 110.729 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.465 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 22.3 t-105 -63.48 -38.41 91.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.96 -0.564 . . . . 74.409999999999997 111.332 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.628 ' HB3' ' HB1' ' A' ' 11' ' ' ALA . . . -65.72 -31.85 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.547 -0.297 . . . . 75.409999999999997 111.392 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.46 HD23 ' HE2' ' A' ' 37' ' ' MET . 44.4 tp -64.85 -38.52 91.27 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.864 -0.421 . . . . 75.209999999999994 109.864 177.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.524 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 72.150000000000006 110.312 177.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . 0.414 ' HA ' ' NE ' ' B' ' 242' ' ' ARG . 1.0 OUTLIER -58.68 -48.86 79.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 75.219999999999999 111.53 178.022 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.662 ' HD2' HG21 ' A' ' 15' ' ' ILE . 11.3 t80 -75.33 -36.85 60.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.968 -0.56 . . . . 73.340000000000003 111.494 -173.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -74.88 -40.52 60.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.835 0.35 . . . . 74.109999999999999 111.266 -176.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . 0.451 ' HA ' ' HE3' ' A' ' 81' ' ' MET . . . -66.82 -22.47 66.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.932 0.396 . . . . 62.229999999999997 111.272 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -57.56 -31.81 66.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.606 -0.724 . . . . 72.409999999999997 110.565 175.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.536 ' CZ ' HG23 ' A' ' 29' ' ' THR . 71.3 m-85 -74.79 -11.03 60.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.238 -0.437 . . . . 73.019999999999996 111.526 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.535 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -70.13 -31.35 69.27 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.477 -0.868 . . . . 55.340000000000003 111.186 175.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 22.6 t -74.15 -7.84 54.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.807 0.337 . . . . 70.349999999999994 110.942 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -120.86 21.59 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.354 0.597 . . . . 73.109999999999999 109.613 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 7.2 t -91.0 -38.69 12.66 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.691 -0.686 . . . . 62.200000000000003 111.289 -175.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.599 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -138.0 -170.07 2.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.204 0.526 . . . . 75.519999999999996 111.955 -176.888 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' B' ' 254' ' ' THR . 14.7 pt-20 -100.38 -49.82 4.12 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.349 -0.842 . . . . 75.030000000000001 111.237 -176.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.407 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 70.4 p -111.28 155.98 22.2 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.521 -0.309 . . . . 65.540000000000006 110.391 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.802 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 5.9 ptmm? -68.29 -27.26 66.16 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.812 -0.355 . . . . 62.32 110.588 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.25 -53.86 53.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.135 0.493 . . . . 71.319999999999993 110.327 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.678 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 14.4 mt-30 -79.1 -36.01 41.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.717 -0.674 . . . . 73.310000000000002 110.372 -177.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.703 ' HE3' HG12 ' A' ' 85' ' ' ILE . 20.4 ttt -61.9 -40.04 94.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.747 -0.661 . . . . 53.149999999999999 111.047 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.643 ' HA ' HD13 ' A' ' 85' ' ' ILE . 4.8 tp-100 -59.98 -41.57 92.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.957 -0.565 . . . . 70.109999999999999 110.823 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.99 -17.29 62.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.777 -0.647 . . . . 74.540000000000006 111.064 -178.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.678 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.3 mmmt -91.58 -18.16 24.5 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 110.523 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.414 ' HZ3' ' CG ' ' A' ' 78' ' ' ASP . 31.2 ttpt -48.41 -61.64 1.91 Allowed 'General case' 0 N--CA 1.443 -0.818 0 O-C-N 123.709 0.63 . . . . 71.349999999999994 110.439 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.01 -26.02 65.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.004 -0.544 . . . . 73.129999999999995 111.021 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -74.26 -35.94 63.81 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.988 -0.285 . . . . 75.219999999999999 111.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 19.0 ptp -83.65 -25.32 30.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.104 -0.702 . . . . 61.409999999999997 109.104 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.605 ' HE2' ' HB2' ' A' ' 78' ' ' ASP . 58.9 mtp -80.7 -24.67 38.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.16 -0.927 . . . . 73.409999999999997 111.784 179.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.18 -35.69 71.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.909 0.385 . . . . 65.519999999999996 111.93 -168.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.591 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 25.2 p90 -103.33 -3.41 25.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.291 -0.413 . . . . 70.140000000000001 110.903 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.707 ' HD2' HD23 ' A' ' 77' ' ' LEU . 2.1 m-30 -65.84 -42.72 90.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.452 0.168 . . . . 75.409999999999997 111.115 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.702 ' HE1' ' HA ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -57.23 -44.62 83.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.538 0.685 . . . . 75.239999999999995 109.577 174.779 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -86.06 17.39 3.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.98 -1.009 . . . . 73.349999999999994 111.621 -172.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 2.0 mmm180 -89.61 -47.88 7.67 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.501 -0.749 . . . . 73.439999999999998 110.94 -174.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.692 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.22 12.23 33.63 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.099 0.476 . . . . 72.239999999999995 109.796 -176.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -58.43 -57.98 10.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.41 -0.814 . . . . 73.519999999999996 110.341 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -60.76 -37.99 83.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.723 -0.671 . . . . 64.200000000000003 111.111 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 48.9 mtt -59.59 -45.55 91.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.433 0.635 . . . . 73.340000000000003 110.092 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.611 HD21 ' HE2' ' B' ' 281' ' ' MET . 6.3 tt -71.56 -42.1 68.26 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.175 -0.92 . . . . 73.439999999999998 110.413 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.592 ' HB2' ' HE2' ' A' ' 66' ' ' MET . 12.1 t70 -56.8 -41.98 78.68 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.468 0.651 . . . . 71.450000000000003 110.301 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.06 -13.32 62.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.902 -1.044 . . . . 73.129999999999995 112.189 -177.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -98.9 -7.95 26.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.987 0.422 . . . . 75.209999999999994 110.391 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.611 ' HE2' HD21 ' B' ' 277' ' ' LEU . 55.1 mtt -94.19 -50.77 5.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.221 -0.445 . . . . 74.019999999999996 111.08 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 0.0 OUTLIER -57.13 -25.8 59.45 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.49 -0.777 . . . . 72.530000000000001 111.968 -173.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.56 -42.57 92.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.055 -0.52 . . . . 64.019999999999996 110.448 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -82.36 -34.47 28.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 71.450000000000003 110.516 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 281' ' ' MET . 69.0 mt -58.22 -58.02 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 116.228 -0.442 . . . . 75.200000000000003 111.677 -177.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.0 pt-20 -64.49 -29.06 70.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.34 -0.391 . . . . 74.120000000000005 111.346 -175.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -100.04 12.45 36.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.721 -0.218 . . . . 64.530000000000001 111.342 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.545 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 78.3 t80 -55.31 -56.94 14.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.727 -0.215 . . . . 71.0 111.19 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 22.9 t70 . . . . . 0 C--N 1.328 -0.35 0 CA-C-O 120.82 0.343 . . . . 71.329999999999998 110.598 -176.836 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.7 p-10 . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 109.483 -0.562 . . . . 62.32 109.483 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -67.99 -83.4 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.438 . . . . 75.109999999999999 111.0 -176.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -111.9 -42.16 3.85 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.854 -0.612 . . . . 71.409999999999997 109.511 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.709 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -93.45 154.02 18.16 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.859 -0.61 . . . . 75.400000000000006 110.097 174.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.439 ' HB2' ' HD2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -78.36 51.91 1.08 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.602 -0.726 . . . . 74.109999999999999 112.478 -177.333 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -51.91 -46.95 64.81 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.847 0.356 . . . . 73.030000000000001 111.46 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.2 -6.07 36.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.913 -0.585 . . . . 75.430000000000007 112.359 -173.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.439 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 84.7 mtt180 -100.11 -60.71 1.48 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.926 -0.398 . . . . 74.549999999999997 109.926 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.691 ' HA ' HD22 ' A' ' 14' ' ' LEU . . . -54.27 -25.65 24.63 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.594 0.59 . . . . 72.400000000000006 112.594 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.9 t -62.13 -26.53 68.37 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.743 -0.208 . . . . 73.049999999999997 111.362 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.536 ' HB2' HD11 ' B' ' 217' ' ' LEU . 26.5 mt-10 -84.39 -25.14 29.3 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.354 0.597 . . . . 75.25 109.705 -178.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.691 HD22 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -68.56 -49.53 58.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.31 -0.859 . . . . 72.109999999999999 109.203 177.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.539 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.2 mt -64.91 -29.28 46.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.643 -0.708 . . . . 73.430000000000007 109.807 175.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -62.5 -38.0 88.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.804 -0.634 . . . . 74.219999999999999 111.085 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.488 HD11 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -65.92 -47.42 74.83 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.873 -0.788 . . . . 65.120000000000005 108.873 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.59 -35.85 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.39 -0.823 . . . . 73.450000000000003 110.969 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.609 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 5.1 m-80 -58.94 -34.5 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 75.109999999999999 111.347 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.0 -41.58 67.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.242 -0.435 . . . . 73.340000000000003 111.271 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -74.11 -20.51 60.23 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.346 0.593 . . . . 73.219999999999999 109.909 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.559 HD22 HG23 ' A' ' 29' ' ' THR . 2.9 t-20 -83.51 -4.91 58.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.302 -0.863 . . . . 74.439999999999998 110.751 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 26.4 mt-30 -82.54 17.83 1.67 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.396 -0.365 . . . . 73.049999999999997 111.162 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.837 HD21 HG13 ' A' ' 27' ' ' ILE . 18.6 t30 -105.33 156.96 17.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.759 0.314 . . . . 72.400000000000006 110.616 -177.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 t -100.63 -37.02 8.94 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.837 0.68 . . . . 72.439999999999998 112.837 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.8 pm0 -85.23 -2.44 58.05 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.752 -0.379 . . . . 72.420000000000002 110.951 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.837 HG13 HD21 ' A' ' 24' ' ' ASN . 8.6 mt -96.91 145.44 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.526 0.679 . . . . 73.120000000000005 110.252 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.632 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 9.0 mt-30 -79.66 140.71 36.97 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.716 -1.129 . . . . 73.319999999999993 108.105 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.559 HG23 HD22 ' A' ' 22' ' ' ASN . 17.4 m -58.38 -24.83 61.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.987 0.422 . . . . 72.209999999999994 111.06 -176.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -82.17 -11.73 81.9 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.868 -0.605 . . . . 73.049999999999997 113.833 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.632 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 50.2 mt-10 -70.21 -31.31 68.68 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 117.97 0.885 . . . . 70.540000000000006 110.286 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 19.0 t -79.45 -32.76 14.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.642 -0.708 . . . . 64.109999999999999 109.901 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.407 ' HG ' ' HE2' ' B' ' 247' ' ' PHE . 0.7 OUTLIER -63.66 -42.57 98.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.608 -0.723 . . . . 73.25 110.202 177.354 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.04 -36.22 81.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.624 -0.716 . . . . 74.219999999999999 111.177 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.446 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 3.6 p -71.96 -27.71 62.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.420000000000002 110.458 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.589 ' CD1' HD11 ' B' ' 214' ' ' LEU . 11.4 t80 -69.6 -37.57 76.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.415 -0.587 . . . . 72.209999999999994 109.415 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.721 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 12.1 ttt -72.73 -49.85 28.4 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.892 -0.595 . . . . 75.219999999999999 111.104 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -52.4 -41.66 63.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.497 -0.774 . . . . 75.549999999999997 110.831 174.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.566 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.97 -33.78 76.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 74.340000000000003 111.348 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.564 HD21 ' HG3' ' B' ' 237' ' ' MET . 58.3 tp -65.65 -35.64 81.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.024 0.44 . . . . 72.430000000000007 110.136 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.439 ' HB2' ' HA ' ' B' ' 277' ' ' LEU . . . -63.4 -44.26 95.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.783 -0.644 . . . . 74.150000000000006 110.715 178.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -67.21 -24.12 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.215 -0.448 . . . . 64.349999999999994 110.99 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.414 ' HD1' HG22 ' B' ' 215' ' ' ILE . 3.1 t80 -90.02 -47.43 7.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.29 -0.414 . . . . 65.120000000000005 110.836 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -65.44 -26.04 67.79 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.1 0.407 . . . . 73.129999999999995 112.1 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.43 -14.53 62.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.787 0.327 . . . . 72.340000000000003 111.259 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -61.58 -31.92 72.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 75.049999999999997 110.342 176.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.869 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 55.0 m-85 -70.65 -12.99 61.9 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 111.226 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.49 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -65.54 -32.63 83.91 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.22 -0.991 . . . . 62.219999999999999 110.643 173.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.755 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 15.3 m -78.23 -9.57 59.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.009 0.433 . . . . 34.439999999999998 110.857 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 63.2 p -106.71 -3.1 20.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.184 0.516 . . . . 61.030000000000001 110.324 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.1 t -72.84 -43.37 62.73 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.67 -0.696 . . . . 75.030000000000001 110.522 -175.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.451 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 11.0 m-85 -149.72 178.1 9.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.921 -0.582 . . . . 71.140000000000001 110.596 -177.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.6 pt-20 -98.61 -52.65 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.059 -0.519 . . . . 74.349999999999994 111.129 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.411 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.6 p -88.01 148.59 24.45 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 116.596 -0.275 . . . . 72.430000000000007 110.523 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.437 ' HB2' ' HE2' ' A' ' 55' ' ' LYS . 7.8 ptmm? -66.28 -25.34 66.82 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.869 -0.332 . . . . 75.109999999999999 110.62 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -64.59 -41.65 96.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.437 . . . . 71.510000000000005 110.613 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.71 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.6 mt-30 -85.93 -37.99 18.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.996 -0.547 . . . . 71.349999999999994 109.806 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.755 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.6 ttt -63.88 -43.43 96.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.586 -0.734 . . . . 63.329999999999998 111.618 -177.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.573 ' HA ' HD13 ' B' ' 285' ' ' ILE . 42.9 tt0 -68.86 -34.92 76.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.36 -0.382 . . . . 75.530000000000001 111.154 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.07 2.56 10.35 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.205 -0.452 . . . . 73.140000000000001 111.613 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.6 mmmt -113.52 -2.44 13.87 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 110.092 -0.336 . . . . 73.340000000000003 110.092 -177.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.74 -57.9 6.38 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 123.721 0.638 . . . . 75.420000000000002 110.889 -175.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -80.07 -20.96 43.98 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 110.254 -0.276 . . . . 74.239999999999995 110.254 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -73.53 -39.61 64.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 63.420000000000002 111.866 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.49 ' SD ' ' HA2' ' A' ' 48' ' ' GLY . 2.5 ptt? -84.32 -19.12 34.24 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 119.9 -0.72 . . . . 72.109999999999999 109.483 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.477 ' HE3' ' HB2' ' B' ' 278' ' ' ASP . 46.0 mtp -85.35 -21.85 28.72 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.276 -0.874 . . . . 73.150000000000006 111.35 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.114 0.483 . . . . 72.109999999999999 111.072 -171.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.583 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.6 p90 -96.99 -8.12 31.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.863 -0.608 . . . . 75.239999999999995 111.073 -178.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.509 ' HD2' HD23 ' B' ' 277' ' ' LEU . 2.6 m-30 -61.4 -40.16 93.38 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 120.576 0.227 . . . . 72.349999999999994 111.009 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.6 ' SD ' ' HE3' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -55.69 -50.75 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.323 0.582 . . . . 73.109999999999999 110.224 174.795 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.524 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 1.9 t70 -88.02 27.45 1.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.238 -0.892 . . . . 71.200000000000003 111.467 -170.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.583 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 17.3 mmm180 -91.95 -54.45 3.85 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.17 -0.331 . . . . 70.430000000000007 111.317 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.711 ' HB3' ' HG2' ' B' ' 237' ' ' MET . 0.1 OUTLIER -79.33 5.62 12.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.181 0.515 . . . . 71.209999999999994 110.527 -177.372 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.74 -45.93 92.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.501 -0.772 . . . . 73.400000000000006 110.684 -179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.51 -33.11 74.96 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.726 -0.67 . . . . 72.349999999999994 111.097 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -69.2 -41.1 77.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.341 0.591 . . . . 64.530000000000001 109.951 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.805 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 0.7 OUTLIER -65.36 -38.84 91.26 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.906 -1.043 . . . . 74.230000000000004 111.423 -174.539 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -65.21 -33.56 76.29 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.1 0.476 . . . . 52.450000000000003 110.795 -178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.96 -14.84 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.895 -0.593 . . . . 73.349999999999994 110.753 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -92.22 -20.39 21.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.555 . . . . 71.439999999999998 110.383 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.459 ' C ' ' H ' ' A' ' 83' ' ' ASP . 24.0 mmt -77.2 -168.26 1.07 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.935 -0.575 . . . . 63.329999999999998 110.936 177.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 1.038 ' HA ' HD12 ' A' ' 85' ' ' ILE . 48.6 mt-10 66.98 -7.69 0.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.994 -1.003 . . . . 72.129999999999995 112.201 -178.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.472 ' O ' HG13 ' A' ' 85' ' ' ILE . 41.8 t0 -79.15 150.61 31.67 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.732 -0.84 . . . . 75.510000000000005 108.732 172.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.463 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 3.1 m-85 73.13 -40.92 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.589 1.155 . . . . 74.430000000000007 110.672 -172.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 1.038 HD12 ' HA ' ' A' ' 82' ' ' GLU . 7.4 mt -56.72 -57.63 8.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.269 -0.878 . . . . 73.319999999999993 111.131 177.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.468 ' HG3' ' ND2' ' A' ' 87' ' ' ASN . 7.9 pt-20 -57.75 -26.54 61.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.172 -0.922 . . . . 71.530000000000001 111.356 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.468 ' ND2' ' HG3' ' A' ' 86' ' ' GLU . 56.6 m-80 -100.43 2.82 42.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.409999999999997 111.47 -175.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -58.72 -48.22 81.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 72.329999999999998 110.452 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.079 -0.51 . . . . 74.409999999999997 110.334 178.666 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 . . . . . 0 CA--C 1.521 -0.147 0 CA-C-O 120.917 0.389 . . . . 73.209999999999994 111.056 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.62 -86.51 0.15 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.997 -0.547 . . . . 63.149999999999999 110.321 173.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -111.6 -24.83 9.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.063 0.459 . . . . 62.119999999999997 110.546 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -94.76 -160.41 0.78 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.942 -0.572 . . . . 71.140000000000001 111.608 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -127.29 44.47 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.649 -0.705 . . . . 72.400000000000006 110.907 -176.575 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -52.89 -49.11 66.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.936 -0.575 . . . . 74.439999999999998 111.927 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.99 -25.57 63.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.82 -0.627 . . . . 65.329999999999998 112.027 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -82.64 -60.64 2.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 110.184 -0.302 . . . . 73.519999999999996 110.184 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.552 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -56.69 -27.29 58.6 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.872 0.693 . . . . 72.230000000000004 112.872 -176.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.1 t -68.59 -20.16 64.5 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.851 0.358 . . . . 73.230000000000004 110.976 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -80.81 -31.5 35.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.479 0.657 . . . . 75.150000000000006 109.283 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.589 HD11 ' CD1' ' A' ' 36' ' ' PHE . 3.6 mm? -66.4 -50.58 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.867 -1.06 . . . . 74.209999999999994 110.017 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.566 HG13 ' HB1' ' A' ' 39' ' ' ALA . 75.0 mt -63.82 -32.05 55.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.878 -0.601 . . . . 74.140000000000001 110.373 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -60.11 -34.09 73.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.462 -0.79 . . . . 71.439999999999998 110.985 -177.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 14' ' ' LEU . 3.3 tm? -69.7 -40.42 76.34 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.288 -0.634 . . . . 70.510000000000005 109.288 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -63.06 -31.83 73.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.014 -0.539 . . . . 73.310000000000002 110.674 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.74 -31.62 72.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 73.230000000000004 110.76 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.11 -18.05 53.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.114 -0.494 . . . . 73.219999999999999 111.131 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . 0.4 ' OE1' HD21 ' A' ' 14' ' ' LEU . 70.5 mt-30 -92.38 -25.04 18.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.232 0.539 . . . . 74.030000000000001 110.021 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -79.14 4.46 14.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.753 -0.658 . . . . 73.319999999999993 109.968 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -73.47 -10.68 59.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.012 -0.736 . . . . 75.109999999999999 109.012 172.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.633 HD21 ' HG2' ' B' ' 226' ' ' GLU . 2.7 m120 -77.78 134.87 37.95 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.078 -0.964 . . . . 62.43 110.855 175.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.5 t -115.35 -15.63 11.54 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.397 -0.819 . . . . 73.420000000000002 108.823 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . 0.633 ' HG2' HD21 ' B' ' 224' ' ' ASN . 1.6 pm0 -76.52 -22.76 53.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.969 -1.014 . . . . 75.510000000000005 110.423 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.401 HG21 ' N ' ' B' ' 228' ' ' GLN . 10.0 mt -98.29 156.37 3.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.269 -0.423 . . . . 73.319999999999993 109.941 177.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.526 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 11.7 mt-30 -76.01 138.88 41.19 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.519 -0.548 . . . . 75.310000000000002 109.519 174.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 26.9 m -60.14 -29.72 68.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.532 . . . . 72.450000000000003 110.436 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . 0.869 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -63.93 -26.8 70.45 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 115.62 -0.718 . . . . 70.129999999999995 113.048 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.526 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 34.5 mt-10 -72.8 -31.19 64.67 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 117.233 0.517 . . . . 72.549999999999997 110.468 -177.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 43.7 t -73.3 -36.9 50.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.355 0.597 . . . . 75.409999999999997 110.265 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 5.9 t -72.36 -37.75 68.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.957 -0.565 . . . . 74.519999999999996 109.73 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.36 -33.05 73.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.822 -0.627 . . . . 62.420000000000002 111.383 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 3.5 p -69.52 -28.79 66.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.795 0.331 . . . . 62.520000000000003 110.456 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.605 ' CD1' HD12 ' A' ' 14' ' ' LEU . 7.7 t80 -69.77 -37.07 76.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.536 0.684 . . . . 72.430000000000007 109.17 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.711 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 11.1 ttt -71.76 -52.91 15.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.451 -0.795 . . . . 64.409999999999997 111.251 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 14.1 t-105 -52.35 -39.9 61.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.49 -0.777 . . . . 75.010000000000005 111.061 175.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.539 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.43 -36.76 84.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 75.450000000000003 111.126 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 57.7 tp -65.82 -35.18 79.97 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.864 0.364 . . . . 70.219999999999999 110.33 179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.77 73.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 74.349999999999994 110.781 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -64.66 -33.59 76.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.099 -0.501 . . . . 73.109999999999999 110.84 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -74.36 -39.55 62.69 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.947 -0.569 . . . . 75.329999999999998 111.021 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.13 -24.1 51.69 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.936 0.347 . . . . 71.299999999999997 111.936 -178.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -70.19 -17.48 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 72.239999999999995 111.089 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -59.0 -38.11 78.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.851 -0.613 . . . . 74.409999999999997 110.251 175.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.407 ' HE2' ' HG ' ' A' ' 33' ' ' SER . 87.6 m-85 -75.81 3.22 10.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.625 -0.716 . . . . 73.140000000000001 111.82 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.49 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -65.39 -35.01 90.88 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 119.983 -1.103 . . . . 72.439999999999998 110.438 171.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 249' ' ' SER . . . . . 0.633 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 78.9 p -77.66 -6.67 54.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.285 -0.458 . . . . 64.230000000000004 111.362 -177.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 62.4 p -109.38 -1.94 18.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.085 0.469 . . . . 70.140000000000001 110.408 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 24.0 t -81.44 -39.8 24.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.721 -0.672 . . . . 72.530000000000001 110.771 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.669 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 1.7 m-85 -145.13 178.71 7.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.132 0.492 . . . . 73.430000000000007 112.075 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.452 ' HG3' HG22 ' B' ' 254' ' ' THR . 13.5 pt-20 -104.5 -43.91 5.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.269 -0.878 . . . . 74.230000000000004 111.516 -172.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.452 HG22 ' HG3' ' B' ' 253' ' ' GLU . 45.7 p -104.77 149.4 25.66 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 116.523 -0.308 . . . . 64.409999999999997 110.287 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.408 ' HB2' ' HE2' ' B' ' 255' ' ' LYS . 10.5 ptmm? -69.62 -26.83 64.62 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.846 0.355 . . . . 73.109999999999999 110.218 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -53.01 -51.35 61.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.64 -0.709 . . . . 71.530000000000001 110.579 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.585 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.0 mt-30 -83.7 -46.69 12.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.561 -0.745 . . . . 72.400000000000006 110.344 -178.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.633 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.6 ttt -56.35 -41.74 76.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.458 -0.792 . . . . 72.310000000000002 111.829 -175.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.622 ' HB2' HG21 ' A' ' 85' ' ' ILE . 28.7 tt0 -69.59 -36.41 76.2 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.673 0.273 . . . . 73.519999999999996 110.989 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.68 -6.22 51.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.345 0.593 . . . . 55.420000000000002 110.495 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.669 ' HE3' ' CE2' ' B' ' 252' ' ' PHE . 70.6 mmtt -99.03 -2.33 37.48 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.531 -0.759 . . . . 74.010000000000005 110.944 -177.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.708 ' HG3' ' H ' ' B' ' 263' ' ' GLN . 11.6 ptpt -50.73 -50.77 54.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.853 -0.612 . . . . 71.200000000000003 110.546 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.708 ' H ' ' HG3' ' B' ' 262' ' ' LYS . 12.5 tp60 -79.47 -22.14 44.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 116.145 -0.48 . . . . 72.040000000000006 110.533 -176.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.55 -30.8 37.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.239 -0.437 . . . . 75.450000000000003 111.408 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.49 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 24.0 ptp -83.75 -31.49 25.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.648 -0.871 . . . . 72.519999999999996 108.648 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.805 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 59.2 mtp -82.64 -3.37 56.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.259 -0.882 . . . . 73.219999999999999 110.442 176.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.44 -42.73 98.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.132 -0.486 . . . . 74.25 110.629 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.647 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 21.0 p90 -105.63 -9.04 17.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.865 -0.607 . . . . 70.120000000000005 111.079 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.557 ' O ' ' HE2' ' A' ' 37' ' ' MET . 3.5 m-30 -55.41 -51.13 67.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 O-C-N 123.074 0.233 . . . . 72.420000000000002 110.785 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.53 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -50.44 -58.5 5.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.893 -0.594 . . . . 74.010000000000005 110.74 176.73 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . 0.451 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 19.6 t70 -87.2 63.69 7.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.658 -0.701 . . . . 72.420000000000002 111.108 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.647 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 4.9 mmp_? -121.97 -45.66 2.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.111 -0.495 . . . . 74.519999999999996 111.284 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.721 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -92.03 13.28 19.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.3 . . . . 74.040000000000006 110.515 -174.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.6 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.0 ttmt -59.3 -54.31 48.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 65.120000000000005 110.84 -178.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -59.97 -41.56 92.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.397 -0.365 . . . . 70.109999999999999 111.41 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.18 -47.97 83.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.385 0.612 . . . . 74.109999999999999 109.963 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.547 HD21 ' HE3' ' A' ' 70' ' ' MET . 41.5 tp -63.18 -36.65 84.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.875 -1.057 . . . . 75.420000000000002 110.504 -178.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.477 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 9.1 t70 -63.71 -42.08 98.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.73 -0.668 . . . . 70.140000000000001 110.458 177.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -76.33 -14.99 60.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.649 -0.705 . . . . 55.130000000000003 111.324 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -94.85 -2.82 50.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.061 0.457 . . . . 74.239999999999995 110.72 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 19.0 mmt -89.49 179.77 5.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.883 -0.599 . . . . 73.540000000000006 110.684 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.685 ' HG2' HD11 ' B' ' 285' ' ' ILE . 42.1 mt-10 69.2 7.13 6.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.292 1.219 . . . . 63.450000000000003 114.292 166.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -64.78 -51.35 62.69 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.969 0.414 . . . . 72.329999999999998 110.297 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -77.14 -23.61 51.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.262 -0.426 . . . . 75.340000000000003 110.477 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.685 HD11 ' HG2' ' B' ' 282' ' ' GLU . 68.5 mt -65.19 -53.19 43.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.936 -0.574 . . . . 70.349999999999994 110.862 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 11.3 pt-20 -67.49 -20.96 65.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.319999999999993 111.78 -178.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . 0.406 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 51.5 m-80 -106.54 5.59 29.3 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.778 0.288 . . . . 72.400000000000006 111.778 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.88 -47.42 80.5 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.116 -0.234 . . . . 72.140000000000001 111.187 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 116.149 -0.478 . . . . 71.099999999999994 111.013 -178.707 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.684 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.0 p-10 . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 109.018 -0.734 . . . . 74.340000000000003 109.018 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -78.79 -80.27 0.12 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.173 -0.467 . . . . 74.230000000000004 112.011 -171.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -98.78 -21.31 16.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.356 0.598 . . . . 74.530000000000001 110.768 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.684 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -133.16 -179.75 5.69 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.792 -0.64 . . . . 62.229999999999997 111.46 -173.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.436 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -83.67 46.13 1.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.334 -0.848 . . . . 70.310000000000002 111.871 -176.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -55.42 -41.13 72.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.772 0.32 . . . . 71.010000000000005 111.55 -176.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.39 -13.41 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 54.350000000000001 111.878 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.436 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 41.4 mmt180 -93.32 -60.34 1.81 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.765 -0.198 . . . . 73.040000000000006 110.627 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -54.31 -22.44 12.02 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.805 0.669 . . . . 73.120000000000005 112.805 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.578 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.7 t -68.37 -22.41 64.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.678 0.275 . . . . 71.25 110.768 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HB2' HD12 ' B' ' 217' ' ' LEU . 41.3 mt-10 -81.04 -27.61 35.69 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.319 0.58 . . . . 74.430000000000007 109.631 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.74 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -70.36 -48.53 55.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.205 -0.907 . . . . 72.109999999999999 109.724 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.481 HG13 ' HB3' ' B' ' 239' ' ' ALA . 80.6 mt -66.53 -27.86 41.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.469 0.652 . . . . 74.450000000000003 109.91 175.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.1 OUTLIER -66.74 -29.07 68.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.448 -0.796 . . . . 74.430000000000007 110.743 -177.362 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.634 HD11 HD12 ' B' ' 214' ' ' LEU . 2.8 tm? -75.25 -36.67 61.25 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.329 -0.619 . . . . 71.450000000000003 109.329 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.16 -28.45 70.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.801 -0.636 . . . . 64.409999999999997 110.462 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -76.9 -19.27 57.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.941 -0.572 . . . . 72.219999999999999 110.263 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.501 HE21 ' HD2' ' A' ' 16' ' ' LYS . 76.0 mm-40 -73.02 -41.82 63.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.68 -0.691 . . . . 71.409999999999997 109.474 176.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -78.93 -19.88 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.31 -0.859 . . . . 75.329999999999998 110.034 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.41 -5.86 53.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.663 -0.699 . . . . 74.239999999999995 110.128 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -75.55 -9.77 58.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.24 -0.436 . . . . 74.200000000000003 110.607 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.479 HD21 HG13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -78.64 111.48 14.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 72.439999999999998 109.726 178.579 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.438 ' H ' HG23 ' A' ' 25' ' ' THR . 2.9 t -73.37 -27.28 61.39 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.809 -0.632 . . . . 74.400000000000006 112.018 -174.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.26 -3.39 59.04 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.494 0.553 . . . . 64.219999999999999 112.494 -177.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.479 HG13 HD21 ' A' ' 24' ' ' ASN . 7.1 mt -107.45 149.51 10.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.806 -0.442 . . . . 74.329999999999998 109.806 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.08 145.06 32.63 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.16 -0.681 . . . . 72.099999999999994 109.16 177.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.523 HG23 ' HZ ' ' B' ' 247' ' ' PHE . 6.6 m -60.35 -25.11 65.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.203 0.525 . . . . 71.340000000000003 110.382 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.66 -15.74 71.3 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.691 -0.686 . . . . 73.209999999999994 112.884 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -81.28 -31.94 33.45 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.367 -0.605 . . . . 74.239999999999995 109.367 176.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -72.36 -44.78 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.467 -0.788 . . . . 74.409999999999997 110.443 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.0 p -60.91 -39.37 89.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.181 0.515 . . . . 71.409999999999997 110.471 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.56 72.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 74.310000000000002 110.788 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.413 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 51.6 m -67.96 -37.27 81.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.769 0.318 . . . . 75.310000000000002 110.159 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.55 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.1 t80 -68.24 -36.18 79.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.105 -0.702 . . . . 75.230000000000004 109.105 175.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.637 ' HE2' ' O ' ' B' ' 269' ' ' TYR . 10.3 tpt -60.18 -60.75 3.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.919 -1.037 . . . . 73.219999999999999 110.974 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.486 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 30.7 t-105 -59.52 -33.68 71.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.477 -0.783 . . . . 73.340000000000003 111.428 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.433 ' HB3' HG13 ' B' ' 215' ' ' ILE . . . -66.0 -41.52 90.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 64.109999999999999 111.586 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.589 HD12 ' HB3' ' B' ' 236' ' ' PHE . 50.3 tp -67.35 -33.1 74.53 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.983 0.42 . . . . 74.540000000000006 110.482 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -62.2 -40.12 95.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 40.140000000000001 110.839 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 42' ' ' ARG . 38.2 mtp85 -74.74 -34.8 62.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.804 -0.634 . . . . 74.329999999999998 110.823 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.509 ' HD2' HG22 ' B' ' 215' ' ' ILE . 9.9 t80 -76.53 -35.38 58.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 74.450000000000003 110.739 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -75.1 -34.95 61.78 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 111.807 0.299 . . . . 74.400000000000006 111.807 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.455 ' HA ' ' CE ' ' B' ' 281' ' ' MET . . . -68.47 -14.87 63.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.974 0.416 . . . . 75.5 111.361 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -58.11 -32.72 68.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.764 -0.653 . . . . 72.439999999999998 110.323 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.563 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 78.1 m-85 -80.38 -7.74 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.902 -0.59 . . . . 63.140000000000001 111.917 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.504 ' C ' ' HE3' ' A' ' 58' ' ' MET . . . -58.89 -34.93 80.47 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.452 -0.88 . . . . 64.400000000000006 111.779 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.1 t -72.79 -19.55 61.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.734 0.302 . . . . 71.510000000000005 111.087 -178.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 p -89.72 -14.21 35.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.783 0.325 . . . . 73.400000000000006 110.877 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.1 m -70.91 -32.49 69.44 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.258 -0.428 . . . . 75.150000000000006 111.951 -174.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -179.15 7.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.116 0.484 . . . . 74.430000000000007 111.537 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -99.77 -47.98 4.87 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.083 -0.962 . . . . 75.409999999999997 111.097 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.2 p -99.7 159.1 15.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.691 -0.231 . . . . 75.530000000000001 110.596 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -68.1 -34.95 77.35 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.083 0.24 . . . . 74.409999999999997 111.14 -175.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.31 -47.49 82.02 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.972 0.415 . . . . 73.319999999999993 110.53 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.579 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -75.43 -32.73 60.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 62.219999999999999 110.314 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.504 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 16.1 ttt -66.26 -45.7 79.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.021 -0.536 . . . . 73.549999999999997 110.782 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.43 ' HB2' HG21 ' B' ' 285' ' ' ILE . 34.0 tt0 -67.15 -29.82 69.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.815 -0.63 . . . . 73.120000000000005 110.753 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.84 -4.11 26.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.379 -0.373 . . . . 60.119999999999997 111.692 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.3 mmmm -117.67 4.66 12.32 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 120.75 0.31 . . . . 75.209999999999994 110.491 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.476 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 16.3 ptmt -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.9 -0.591 . . . . 73.540000000000006 110.736 -174.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -68.75 -26.08 65.06 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.87 0.367 . . . . 75.120000000000005 110.559 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.76 -42.97 69.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.974 -0.557 . . . . 65.510000000000005 111.644 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.476 ' CE ' ' HA ' ' A' ' 62' ' ' LYS . 2.8 ptt? -83.75 -27.08 29.15 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.17 -0.612 . . . . 72.400000000000006 109.782 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.616 ' HG2' HD23 ' B' ' 277' ' ' LEU . 75.7 mtp -78.47 -17.79 55.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.628 -0.715 . . . . 75.420000000000002 111.575 -178.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.44 -24.75 66.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.525 -0.917 . . . . 73.299999999999997 108.525 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.536 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 34.7 m-85 -93.71 -32.96 13.82 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 114.414 -1.266 . . . . 74.010000000000005 111.199 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.426 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 23.1 m-85 -60.98 -45.13 96.01 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.204 -0.665 . . . . 71.049999999999997 109.204 175.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.475 ' N ' ' HE1' ' A' ' 70' ' ' MET . 0.0 OUTLIER -67.04 -59.83 3.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.375 -0.375 . . . . 72.310000000000002 110.039 169.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -106.34 81.54 1.62 Allowed 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 113.189 0.811 . . . . 74.540000000000006 113.189 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.536 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 7.9 mmm180 -147.13 -31.16 0.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.731 -0.668 . . . . 72.230000000000004 109.757 164.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.614 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -93.08 10.87 29.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.309 -0.626 . . . . 71.319999999999993 109.309 178.148 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -66.36 -56.32 11.67 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.271 -0.877 . . . . 73.150000000000006 110.076 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.62 -36.81 77.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.477 -0.329 . . . . 64.409999999999997 110.925 177.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.0 mtt -62.67 -41.08 98.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.238 0.542 . . . . 74.010000000000005 110.05 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.589 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.2 tt -71.89 -42.11 67.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.486 -0.779 . . . . 73.400000000000006 110.144 -176.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.74 -39.85 82.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.26 0.553 . . . . 54.210000000000001 109.948 175.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.45 -21.22 66.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.324 -0.853 . . . . 72.129999999999995 111.365 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -93.36 -24.04 18.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 70.439999999999998 110.25 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.423 ' C ' ' H ' ' A' ' 83' ' ' ASP . 25.4 mmt -63.2 -45.59 91.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.523 -0.917 . . . . 73.109999999999999 108.523 169.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 43.4 mm-40 -68.21 12.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.24 -0.891 . . . . 75.230000000000004 111.916 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.423 ' H ' ' C ' ' A' ' 81' ' ' MET . 10.3 t70 -93.01 -55.5 3.32 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.902 -0.777 . . . . 75.439999999999998 108.902 172.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.785 -0.643 . . . . 73.349999999999994 111.808 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.7 mt -62.3 -57.39 12.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.491 0.186 . . . . 73.030000000000001 111.433 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.7 pt-20 -69.18 -15.74 63.47 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.125 0.417 . . . . 60.219999999999999 112.125 -175.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -109.13 10.3 25.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.998 -0.281 . . . . 75.120000000000005 110.942 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 71.5 t80 -57.87 -47.93 81.3 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.451 -0.34 . . . . 72.299999999999997 111.106 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.5 t70 . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 116.384 -0.371 . . . . 72.310000000000002 110.443 -177.011 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.755 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.822 -0.436 . . . . 73.420000000000002 109.822 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -91.05 -75.85 0.46 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.095 -0.706 . . . . 71.109999999999999 109.095 178.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -115.5 -37.38 4.02 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.52 -0.919 . . . . 75.230000000000004 108.52 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.755 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -93.99 150.97 19.88 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.162 -0.926 . . . . 73.049999999999997 111.764 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.465 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -71.68 57.89 0.3 Allowed 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 125.064 1.346 . . . . 75.239999999999995 113.146 -179.639 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -51.67 -43.06 62.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.479 0.548 . . . . 75.420000000000002 112.479 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.25 -27.76 69.23 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.946 0.721 . . . . 74.349999999999994 112.946 -174.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 19.5 mmt180 -87.66 -56.49 3.33 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.939 -0.304 . . . . 72.129999999999995 111.642 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -51.75 -25.73 8.1 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.689 0.626 . . . . 73.129999999999995 112.689 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 212' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 6.2 t -69.32 -23.63 63.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 121.336 -0.146 . . . . 62.299999999999997 111.357 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -81.71 -27.87 33.7 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.1 -0.704 . . . . 72.310000000000002 109.1 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 17' ' ' LEU . 3.4 mm? -67.08 -51.78 50.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.78 -1.1 . . . . 73.310000000000002 109.467 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.509 HG22 ' HD2' ' A' ' 43' ' ' TYR . 78.1 mt -63.67 -30.37 49.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.515 -0.766 . . . . 75.540000000000006 110.227 176.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.0 OUTLIER -59.62 -36.98 77.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.8 -0.636 . . . . 70.319999999999993 110.82 -177.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.604 ' HA ' ' NE2' ' B' ' 220' ' ' GLN . 3.0 tm? -67.61 -40.01 84.74 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.128 -0.693 . . . . 74.439999999999998 109.128 178.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.16 66.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.716 -0.675 . . . . 72.349999999999994 110.707 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.56 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -66.28 -42.06 88.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.781 -0.645 . . . . 74.150000000000006 110.488 176.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . 0.604 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -61.78 -43.85 98.04 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.834 0.349 . . . . 74.430000000000007 111.158 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -70.16 -21.6 63.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.201 0.524 . . . . 74.140000000000001 110.379 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.51 -13.38 59.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.687 -0.688 . . . . 74.540000000000006 109.891 177.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 20.3 mm-40 -83.77 -2.07 55.55 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.318 -0.401 . . . . 75.200000000000003 110.218 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.557 HD21 HG13 ' B' ' 227' ' ' ILE . 1.4 t30 -81.46 103.26 11.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.114 -0.698 . . . . 72.549999999999997 109.114 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.1 t -59.25 -28.77 67.01 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 113.412 0.893 . . . . 74.040000000000006 113.412 -171.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -87.22 -0.29 56.48 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.931 0.345 . . . . 74.329999999999998 111.931 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.557 HG13 HD21 ' B' ' 224' ' ' ASN . 5.7 mt -112.24 149.49 14.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.866 -0.42 . . . . 65.129999999999995 109.866 177.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.457 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 0.3 OUTLIER -88.81 151.41 22.4 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.308 -0.627 . . . . 74.040000000000006 109.308 178.723 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.8 m -57.51 -30.83 65.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.262 0.554 . . . . 64.209999999999994 110.202 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . 0.563 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.8 -16.14 74.22 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.461 -0.79 . . . . 72.209999999999994 113.645 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.457 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 7.7 mm-40 -87.79 -24.98 23.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.552 0.676 . . . . 74.319999999999993 109.642 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.13 -40.4 44.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 73.109999999999999 110.242 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.7 p -63.15 -39.04 93.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.202 0.525 . . . . 73.349999999999994 110.271 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.9 -32.99 74.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.751 -0.659 . . . . 64.329999999999998 110.837 178.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 46.8 m -66.73 -37.37 84.53 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.105 0.478 . . . . 72.409999999999997 110.101 178.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.589 ' HB3' HD12 ' A' ' 40' ' ' LEU . 4.4 t80 -67.76 -35.67 79.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 73.340000000000003 109.696 177.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.614 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.3 ttm -67.06 -50.26 62.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.685 -0.689 . . . . 63.329999999999998 111.489 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -59.49 -38.79 81.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.073 0.463 . . . . 75.120000000000005 110.728 178.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.481 ' HB3' HG13 ' A' ' 15' ' ' ILE . . . -66.09 -41.07 91.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.01 -0.541 . . . . 74.439999999999998 111.443 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.58 HD21 ' SD ' ' A' ' 37' ' ' MET . 53.1 tp -65.67 -33.71 76.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.893 0.378 . . . . 74.340000000000003 110.557 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.2 -40.53 97.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 71.430000000000007 110.773 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.8 mtp85 -70.7 -42.15 71.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.061 -0.518 . . . . 72.340000000000003 110.604 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -70.6 -37.96 73.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.79 -0.641 . . . . 75.299999999999997 111.179 -174.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -71.83 -34.79 69.6 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.964 0.357 . . . . 73.129999999999995 111.964 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -65.74 -25.69 67.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 64.5 111.153 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -59.56 -33.84 71.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.637 -0.71 . . . . 75.200000000000003 110.113 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.523 ' HZ ' HG23 ' A' ' 29' ' ' THR . 71.5 m-85 -83.68 -8.71 59.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.31 -0.405 . . . . 73.209999999999994 111.33 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.494 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -73.56 -30.94 61.38 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.23 -0.986 . . . . 64.329999999999998 110.661 171.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 34.9 t -70.12 -12.25 61.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.299 -0.451 . . . . 62.240000000000002 111.141 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.1 t -113.61 14.07 18.82 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.041 0.448 . . . . 75.150000000000006 110.27 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 29.0 t -88.95 -35.65 16.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.163 -0.472 . . . . 72.420000000000002 110.641 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.485 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.5 OUTLIER -137.95 174.01 11.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.761 0.315 . . . . 75.019999999999996 111.579 178.895 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -92.87 -30.61 15.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.773 -0.649 . . . . 75.549999999999997 112.325 -170.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.2 p -120.58 156.12 32.27 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.811 -0.177 . . . . 65.430000000000007 110.63 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.507 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 12.6 ptmm? -64.33 -29.11 70.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 74.219999999999999 110.37 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . 0.477 ' OE2' ' HG3' ' B' ' 255' ' ' LYS . 19.9 mm-40 -63.4 -57.58 9.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 75.430000000000007 110.651 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.682 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 22.2 mt-30 -68.94 -39.09 79.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.968 -0.56 . . . . 74.540000000000006 110.651 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.454 ' HE1' ' C ' ' B' ' 248' ' ' GLY . 10.2 ttt -60.41 -44.08 96.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.285 -0.416 . . . . 75.099999999999994 110.883 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.514 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 7.8 tt0 -62.79 -35.78 80.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.089 0.471 . . . . 74.549999999999997 110.835 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -74.07 -5.81 43.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.006 -0.543 . . . . 64.230000000000004 111.094 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.682 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 14.3 mmmm -114.3 6.79 16.24 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.509 -0.314 . . . . 74.239999999999995 110.448 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.552 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 17.8 ptpt -56.95 -53.2 60.75 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 120.678 -0.409 . . . . 75.439999999999998 110.226 -177.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.552 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 15.0 tp60 -72.45 -22.01 61.15 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.847 -0.427 . . . . 72.140000000000001 109.847 -177.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -69.91 -42.44 73.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.6 -0.727 . . . . 71.25 111.299 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.494 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 2.6 ptt? -88.13 -27.7 21.74 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.211 0.529 . . . . 73.129999999999995 109.97 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.589 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 80.6 mtp -74.58 -17.51 60.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.684 -0.689 . . . . 75.340000000000003 110.611 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -62.37 -30.12 70.96 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.92 -0.77 . . . . 74.109999999999999 108.92 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.551 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.7 m-85 -86.7 -35.38 19.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.483 -1.235 . . . . 72.409999999999997 111.157 178.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.637 ' O ' ' HE2' ' A' ' 37' ' ' MET . 22.6 m-30 -61.09 -44.29 97.59 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.485 -0.561 . . . . 73.230000000000004 109.485 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.421 ' HE2' ' N ' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.55 -57.3 5.38 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.352 -0.539 . . . . 73.010000000000005 109.679 171.256 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . 0.51 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 7.0 t70 -108.53 81.42 1.47 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.657 0.614 . . . . 74.230000000000004 112.657 -172.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.551 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 5.8 mmm180 -156.81 -26.81 0.09 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.945 -0.57 . . . . 74.049999999999997 110.029 166.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.457 ' HB3' ' HE3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -95.27 9.32 40.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.469 -0.937 . . . . 74.540000000000006 108.469 174.191 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.446 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 62.1 tttm -64.29 -59.32 4.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.248 -1.342 . . . . 74.299999999999997 110.356 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -55.3 -38.86 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 74.409999999999997 111.013 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 276' ' ' MET . . . . . 0.486 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 50.2 mtt -60.63 -40.99 93.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.447 0.641 . . . . 73.430000000000007 110.412 177.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.616 HD23 ' HG2' ' A' ' 66' ' ' MET . 0.9 OUTLIER -75.01 -41.34 59.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.283 -0.871 . . . . 75.439999999999998 110.274 -178.006 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.574 ' HB2' ' HE1' ' A' ' 66' ' ' MET . 9.4 t70 -57.87 -44.53 86.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 74.010000000000005 110.242 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.47 69.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.127 -0.942 . . . . 74.120000000000005 111.748 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -83.57 -21.49 32.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.9 0.381 . . . . 74.400000000000006 110.528 -178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.455 ' CE ' ' HA ' ' A' ' 45' ' ' ALA . 24.3 mmt -68.26 -52.97 27.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.038 -0.528 . . . . 72.430000000000007 110.14 175.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.684 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 40.1 mm-40 -51.08 -37.56 46.43 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.319 -0.855 . . . . 73.099999999999994 112.338 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -50.0 -42.75 49.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.697 0.284 . . . . 62.130000000000003 111.676 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -86.86 -32.16 20.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.857 0.36 . . . . 74.010000000000005 110.595 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.455 HG13 ' O ' ' B' ' 281' ' ' MET . 70.5 mt -66.28 -55.31 19.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.935 -0.575 . . . . 74.140000000000001 111.521 -177.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.684 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -75.08 -6.58 50.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 72.430000000000007 111.758 -175.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -116.37 12.37 15.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.328 -0.396 . . . . 75.530000000000001 110.857 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -53.0 -49.23 66.61 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.192 0.307 . . . . 74.099999999999994 111.037 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.862 -0.608 . . . . 72.109999999999999 111.134 179.341 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.5 p-10 . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 109.612 -0.514 . . . . 75.340000000000003 109.612 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -81.77 -81.66 0.14 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.762 0.315 . . . . 75.439999999999998 110.967 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -111.16 -33.13 6.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.899 0.381 . . . . 74.120000000000005 110.875 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -104.76 159.64 15.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.081 0.467 . . . . 73.420000000000002 111.363 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.1 OUTLIER -76.78 53.66 0.93 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.164 -0.925 . . . . 74.540000000000006 112.481 -177.531 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.416 ' CE1' ' HB1' ' A' ' 6' ' ' ALA . 37.8 m-85 -54.39 -38.99 66.81 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.862 0.363 . . . . 71.109999999999999 111.253 -178.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.44 -14.36 60.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.814 -0.63 . . . . 74.310000000000002 112.207 -176.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.613 ' NH1' ' HB3' ' B' ' 231' ' ' GLU . 64.5 mtt180 -93.5 -59.98 1.88 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.051 -0.352 . . . . 74.430000000000007 110.051 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.47 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.83 -25.94 21.92 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.766 -0.652 . . . . 71.430000000000007 112.657 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.5 t -63.95 -22.9 67.13 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.634 0.254 . . . . 61.229999999999997 111.296 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.502 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.9 mt-10 -90.98 -32.25 16.02 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.913 0.387 . . . . 74.349999999999994 109.969 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.598 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.6 mm? -61.92 -45.96 91.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.157 -0.683 . . . . 73.129999999999995 109.157 176.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.573 HG21 ' HD2' ' B' ' 243' ' ' TYR . 92.3 mt -66.86 -28.42 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.404 -0.817 . . . . 64.310000000000002 110.399 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.2 OUTLIER -68.49 -29.91 68.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.857 -0.61 . . . . 73.109999999999999 110.575 -177.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.485 HD11 HD12 ' B' ' 214' ' ' LEU . 2.2 tm? -69.86 -44.63 69.45 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.69 -0.856 . . . . 75.230000000000004 108.69 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.85 -33.1 74.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.374 -0.83 . . . . 64.439999999999998 109.965 178.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.578 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 5.4 t-20 -57.23 -38.7 74.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.221 -0.9 . . . . 72.319999999999993 110.396 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -67.01 -42.17 85.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 73.319999999999993 111.368 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -74.26 -20.32 60.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.053 0.454 . . . . 74.140000000000001 110.53 -177.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -88.04 0.21 56.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 70.010000000000005 110.68 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.578 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.9 mm-40 -80.77 55.23 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.868 0.366 . . . . 62.420000000000002 110.467 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.509 ' ND2' HG13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -144.62 142.48 30.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 74.349999999999994 109.873 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.5 t -93.18 -43.36 8.89 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.291 0.478 . . . . 71.329999999999998 112.291 -176.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -73.7 -24.75 59.98 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.382 0.512 . . . . 75.450000000000003 112.382 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.509 HG13 ' ND2' ' A' ' 24' ' ' ASN . 5.6 mt -83.76 143.98 10.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.296 -0.631 . . . . 73.510000000000005 109.296 177.192 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.609 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -83.42 150.68 25.9 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.997 -0.547 . . . . 60.030000000000001 110.017 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 m -56.37 -33.28 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.657 -0.702 . . . . 73.019999999999996 111.375 -175.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.578 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -63.14 -26.53 69.33 Favored Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.945 -0.57 . . . . 42.439999999999998 113.997 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.609 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 51.8 mm-40 -62.97 -28.43 70.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 117.318 0.559 . . . . 72.400000000000006 111.172 -176.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.67 -46.78 15.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 73.510000000000005 110.825 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 m -55.7 -40.11 71.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 63.130000000000003 110.983 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.78 68.37 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.14 -0.482 . . . . 64.299999999999997 111.229 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.5 m -66.9 -32.08 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 74.420000000000002 110.107 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.598 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.5 t80 -68.45 -33.11 73.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.872 -0.604 . . . . 74.409999999999997 109.854 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.549 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.5 ttm -68.09 -49.72 59.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 74.510000000000005 111.407 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.477 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 29.3 t-105 -62.02 -37.59 85.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.076 0.465 . . . . 73.25 110.669 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.42 -34.32 76.98 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 70.420000000000002 111.264 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.4 tp -65.64 -35.71 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 120.942 0.401 . . . . 74.230000000000004 110.029 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.511 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -62.11 -54.18 44.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.876 -0.602 . . . . 73.040000000000006 110.985 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -61.9 -32.82 73.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.644 -0.253 . . . . 75.230000000000004 111.602 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -77.4 -39.33 47.49 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.972 -0.291 . . . . 73.0 110.917 -177.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -70.31 -35.41 73.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 75.150000000000006 110.806 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.416 ' HB3' ' HG2' ' B' ' 281' ' ' MET . . . -69.54 -11.53 60.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.488 . . . . 73.239999999999995 111.129 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 19.2 t90 -74.19 -15.28 61.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.444 0.64 . . . . 73.099999999999994 109.833 176.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -97.8 -0.93 44.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.998 0.428 . . . . 75.200000000000003 111.142 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.596 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -74.94 -29.84 60.26 Favored Glycine 0 N--CA 1.443 -0.841 0 C-N-CA 120.47 -0.872 . . . . 74.439999999999998 111.009 176.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.56 ' HA ' ' CE ' ' A' ' 58' ' ' MET . 7.0 p -73.15 -5.37 38.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.754 0.311 . . . . 73.299999999999997 111.826 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -120.19 14.01 12.11 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.428 . . . . 64.129999999999995 110.372 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -76.66 -54.93 5.99 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.163 -0.471 . . . . 64.239999999999995 111.884 -178.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.689 ' HE2' ' HE2' ' A' ' 61' ' ' LYS . 3.0 m-85 -128.87 173.55 10.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.034 0.445 . . . . 74.109999999999999 112.076 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.515 ' HG3' HG22 ' A' ' 54' ' ' THR . 12.1 pt-20 -88.51 -36.08 16.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.28 -0.873 . . . . 73.450000000000003 111.459 -172.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.515 HG22 ' HG3' ' A' ' 53' ' ' GLU . 62.9 p -119.85 151.53 38.72 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 116.105 -0.498 . . . . 74.540000000000006 110.283 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.565 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 21.2 ptmt -68.6 -25.07 64.68 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.652 -0.499 . . . . 74.439999999999998 109.652 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -55.2 -40.39 70.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.579 -0.737 . . . . 71.530000000000001 110.468 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.665 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 15.2 mt-30 -93.84 -43.32 8.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.623 -0.717 . . . . 72.420000000000002 110.311 178.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.64 ' HE3' HG13 ' B' ' 285' ' ' ILE . 24.5 ttt -58.11 -40.64 81.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.642 -0.708 . . . . 74.439999999999998 111.904 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.72 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.8 tt0 -64.38 -41.92 96.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.814 0.34 . . . . 73.450000000000003 110.633 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.56 -18.29 64.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.097 -0.502 . . . . 74.109999999999999 111.164 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HE2' ' HE2' ' A' ' 52' ' ' PHE . 32.3 mmmt -91.28 0.35 57.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.11 -0.495 . . . . 73.340000000000003 110.54 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -55.15 -43.05 73.88 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.829 -0.434 . . . . 73.349999999999994 109.829 -177.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -82.76 -19.61 37.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.278 -0.419 . . . . 71.140000000000001 110.521 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.449 ' CD ' ' HZ1' ' A' ' 61' ' ' LYS . 44.0 mt-10 -87.17 -30.5 20.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.028 -0.533 . . . . 73.099999999999994 111.584 -175.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.423 ' HG3' ' HE3' ' B' ' 281' ' ' MET . 23.3 ptp -82.02 -27.52 33.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.189 -1.041 . . . . 73.239999999999995 108.189 177.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.512 ' HE2' ' HB2' ' B' ' 278' ' ' ASP . 77.8 mtp -85.97 -10.02 55.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.899 -1.046 . . . . 73.120000000000005 110.429 177.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -53.05 -43.55 66.72 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.724 -0.671 . . . . 72.5 111.791 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.565 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 6.6 p90 -109.69 -1.53 17.98 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.159 -0.473 . . . . 75.239999999999995 111.215 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.654 ' HD2' HD23 ' B' ' 277' ' ' LEU . 4.2 m-30 -63.0 -46.99 85.04 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.52 0.2 . . . . 73.530000000000001 110.759 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.451 ' HE1' HD21 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.1 -46.22 72.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.415 0.626 . . . . 75.219999999999999 110.042 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -89.65 14.07 12.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.089 -0.959 . . . . 75.409999999999997 112.172 -168.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.726 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -86.08 -43.05 13.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.584 -0.697 . . . . 73.319999999999993 111.443 -172.065 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.659 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -98.68 15.29 25.68 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.389 -0.524 . . . . 74.319999999999993 110.212 -178.347 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.573 ' HE3' ' HG2' ' B' ' 270' ' ' MET . 32.8 ttmt -62.86 -52.92 61.26 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.705 -0.68 . . . . 72.129999999999995 109.576 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -57.49 -41.41 80.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.137 -0.938 . . . . 74.109999999999999 111.135 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -61.16 -47.32 86.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.262 0.554 . . . . 73.200000000000003 110.592 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.86 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.0 OUTLIER -69.66 -36.09 75.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.245 -0.889 . . . . 74.219999999999999 110.63 -174.551 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -61.12 -31.2 70.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.237 0.542 . . . . 75.329999999999998 110.532 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.9 59.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.602 -0.726 . . . . 72.340000000000003 111.524 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -105.46 -16.57 14.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.057 0.456 . . . . 75.409999999999997 110.662 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.429 ' HE3' ' CD2' ' A' ' 77' ' ' LEU . 20.9 mmt -75.97 -179.15 4.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.797 -0.638 . . . . 73.239999999999995 111.415 177.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.588 ' HA ' HD12 ' A' ' 85' ' ' ILE . 40.5 mt-10 67.8 8.74 6.63 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.878 -1.055 . . . . 72.209999999999994 113.718 171.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.29 -55.26 35.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.145 0.497 . . . . 74.129999999999995 110.648 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -85.24 -10.23 56.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.95 -0.568 . . . . 74.439999999999998 111.012 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.588 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -76.0 -57.33 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 120.757 0.313 . . . . 74.430000000000007 110.744 -178.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.0 pt-20 -66.8 -25.56 66.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.735 0.302 . . . . 74.120000000000005 110.872 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -99.0 7.26 46.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.337 -0.392 . . . . 65.150000000000006 111.304 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -60.02 -39.34 85.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.708 0.289 . . . . 73.239999999999995 110.466 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 . . . . . 0 C--N 1.327 -0.404 0 CA-C-O 121.324 0.583 . . . . 70.140000000000001 110.478 176.597 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.681 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.368 0 N-CA-C 108.805 -0.813 . . . . 74.109999999999999 108.805 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.14 -79.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.799 0.333 . . . . 75.040000000000006 111.502 -176.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.41 -56.32 2.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.1 0.476 . . . . 74.329999999999998 110.112 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -71.28 160.39 32.89 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.757 -0.656 . . . . 72.120000000000005 110.642 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.477 ' HE1' ' CB ' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -76.62 52.26 0.8 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.598 -0.728 . . . . 73.230000000000004 112.251 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.681 ' HD2' ' HB2' ' B' ' 203' ' ' ASN . 55.8 m-85 -55.62 -37.51 68.27 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.965 0.412 . . . . 73.349999999999994 111.179 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -70.49 -20.6 62.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.537 . . . . 74.099999999999994 111.689 -176.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.408 ' NH1' ' HB3' ' A' ' 31' ' ' GLU . 79.4 mtt180 -91.6 -60.6 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.83 0.348 . . . . 74.030000000000001 110.228 -177.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.738 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -56.7 -22.88 38.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.715 -0.675 . . . . 72.120000000000005 112.669 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 212' ' ' THR . . . . . 0.428 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -65.97 -24.82 66.87 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.591 0.234 . . . . 71.319999999999993 110.741 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 38.8 mt-10 -83.04 -25.94 31.64 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.423 0.63 . . . . 71.140000000000001 109.865 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.738 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.59 -42.84 91.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.351 -0.84 . . . . 71.420000000000002 109.512 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 79.6 mt -68.58 -26.53 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.629 -0.714 . . . . 75.120000000000005 110.221 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' B' ' 213' ' ' GLU . 10.6 mmmm -60.73 -42.27 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.056 -0.52 . . . . 75.239999999999995 111.66 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.547 ' O ' HD12 ' B' ' 217' ' ' LEU . 2.6 tm? -64.33 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.164 -0.68 . . . . 73.299999999999997 109.164 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -72.28 -37.55 68.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.777 -0.647 . . . . 74.329999999999998 109.979 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.641 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.2 m-20 -61.0 -34.28 74.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 73.129999999999995 110.689 176.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.07 -38.37 79.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 72.340000000000003 111.572 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -76.61 -22.61 53.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.348 0.594 . . . . 73.219999999999999 110.198 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -78.99 -13.28 59.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.261 -0.882 . . . . 74.510000000000005 110.714 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.641 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 84.8 mm-40 -72.3 -7.36 49.06 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.336 0.495 . . . . 74.109999999999999 112.336 -176.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.698 HD21 HG13 ' B' ' 227' ' ' ILE . 9.5 t30 -71.43 166.8 20.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 72.540000000000006 110.194 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.6 t -116.48 3.01 13.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.772 0.32 . . . . 75.319999999999993 111.43 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -128.93 7.08 5.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.023 0.379 . . . . 74.099999999999994 112.023 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.698 HG13 HD21 ' B' ' 224' ' ' ASN . 4.5 mt -109.9 144.45 18.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.284 -0.566 . . . . 75.219999999999999 110.118 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -79.4 142.26 36.13 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.162 -0.927 . . . . 71.049999999999997 109.066 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 39.3 m -60.2 -27.64 67.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.063 0.459 . . . . 75.409999999999997 110.649 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.85 -15.42 76.01 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.912 -0.585 . . . . 74.420000000000002 112.843 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.613 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 68.1 mm-40 -78.25 -18.22 55.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 117.194 0.497 . . . . 74.120000000000005 110.467 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.3 -38.25 10.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.669 -0.696 . . . . 75.040000000000006 110.497 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.1 p -64.4 -38.77 92.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.236 0.541 . . . . 71.400000000000006 110.347 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.12 -37.47 85.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.776 -0.647 . . . . 74.239999999999995 111.103 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.482 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 2.3 p -71.65 -26.41 62.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.97 -0.292 . . . . 65.230000000000004 110.748 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.533 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 6.9 t80 -70.28 -40.63 74.21 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.088 -0.708 . . . . 72.540000000000006 109.088 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.659 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.7 ttm -65.79 -47.87 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.48 -0.782 . . . . 74.439999999999998 111.344 178.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -60.92 -38.42 85.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.995 0.426 . . . . 74.349999999999994 110.701 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.2 -33.15 75.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 74.420000000000002 111.449 -178.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 36' ' ' PHE . 49.3 tp -70.05 -34.95 73.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.976 0.417 . . . . 75.120000000000005 109.891 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.48 -48.86 77.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.788 -0.642 . . . . 75.329999999999998 110.821 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -77.95 -14.9 59.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 63.310000000000002 111.028 -175.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.573 ' HD2' HG21 ' A' ' 15' ' ' ILE . 28.0 t80 -89.13 -48.91 7.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.222 0.534 . . . . 72.030000000000001 110.349 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -78.58 -16.38 57.48 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.846 -0.615 . . . . 73.150000000000006 112.015 -170.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -66.99 -15.42 63.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.147 0.499 . . . . 74.099999999999994 111.008 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -56.96 -31.74 65.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.443 -0.799 . . . . 73.329999999999998 111.506 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.578 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 67.9 m-85 -73.5 -11.64 60.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.316 -0.402 . . . . 73.209999999999994 112.0 -175.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.634 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -61.49 -38.42 95.76 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.15 -1.024 . . . . 74.010000000000005 111.384 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 249' ' ' SER . . . . . 0.472 ' HA ' ' CE ' ' B' ' 258' ' ' MET . 13.1 m -66.85 -13.17 61.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.057 0.392 . . . . 51.200000000000003 112.057 -175.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.8 t -116.81 18.29 14.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.072 0.463 . . . . 65.409999999999997 110.582 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 30.2 t -83.48 -49.24 9.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 75.239999999999995 111.568 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 1.6 m-85 -139.5 -179.45 5.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.653 0.612 . . . . 74.25 112.653 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.598 ' HG3' HG21 ' B' ' 254' ' ' THR . 15.5 pt-20 -92.13 -36.41 13.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.836 -1.074 . . . . 75.120000000000005 112.043 -171.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.598 HG21 ' HG3' ' B' ' 253' ' ' GLU . 69.8 p -123.17 154.92 38.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.328 -0.396 . . . . 72.109999999999999 110.181 -176.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -65.04 -29.78 70.71 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.154 0.284 . . . . 73.530000000000001 110.72 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -59.0 -53.03 63.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.281 0.562 . . . . 75.349999999999994 110.849 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.615 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.8 mt-30 -78.54 -35.3 46.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.663 -0.699 . . . . 73.409999999999997 110.361 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.634 ' HE2' ' O ' ' B' ' 248' ' ' GLY . 25.6 ttt -64.26 -42.86 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.895 -0.593 . . . . 72.219999999999999 111.105 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.45 -35.48 79.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 75.239999999999995 110.887 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.6 2.9 7.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.925 0.393 . . . . 70.540000000000006 111.459 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.7 mmmt -114.65 -0.16 13.71 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 109.895 -0.409 . . . . 75.340000000000003 109.895 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.448 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 9.9 ptmt -55.22 -52.17 64.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.84 -0.618 . . . . 61.149999999999999 110.942 -173.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.5 tp60 -76.72 -26.05 54.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 109.985 -0.376 . . . . 74.519999999999996 109.985 -177.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -75.05 -34.13 61.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.05 -0.523 . . . . 75.340000000000003 111.633 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 22.0 ptp -81.49 -29.26 33.73 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.372 -0.973 . . . . 75.409999999999997 108.372 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.86 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 68.0 mtp -80.86 -19.17 45.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.914 -1.039 . . . . 73.129999999999995 111.253 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -68.64 -27.32 65.9 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-O 122.079 0.942 . . . . 73.549999999999997 108.5 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -99.94 8.8 43.81 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.216 -1.356 . . . . 74.510000000000005 111.277 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.445 ' C ' ' HH ' ' A' ' 73' ' ' TYR . 22.4 m-30 -97.05 -45.93 6.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 106.951 -1.5 . . . . 75.209999999999994 106.951 165.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.573 ' HG2' ' HE3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -59.69 -66.05 0.58 Allowed 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.407 -0.815 . . . . 73.519999999999996 110.53 170.486 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . 0.573 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 4.8 t70 -102.03 76.5 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.101 0.408 . . . . 73.209999999999994 112.101 -171.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG2' ' O ' ' B' ' 271' ' ' ASP . 1.8 mmp_? -152.23 -28.92 0.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 75.349999999999994 111.383 170.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.549 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.62 1.44 42.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.525 -0.917 . . . . 74.310000000000002 108.525 174.613 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.48 -49.32 77.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.485 -1.234 . . . . 72.409999999999997 110.692 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.75 -42.65 99.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 73.120000000000005 110.866 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 54.3 mtt -61.55 -47.65 84.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.625 -0.716 . . . . 73.420000000000002 109.676 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.654 HD23 ' HD2' ' A' ' 69' ' ' TYR . 34.3 tp -59.9 -42.86 94.77 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.644 -1.162 . . . . 70.430000000000007 111.165 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.512 ' HB2' ' HE2' ' A' ' 66' ' ' MET . 15.1 t70 -61.94 -43.13 99.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.196 0.522 . . . . 73.209999999999994 110.14 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.04 -20.75 60.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.391 -0.822 . . . . 64.450000000000003 111.525 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -87.95 -9.51 53.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 74.299999999999997 110.634 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.429 ' HG3' ' O ' ' B' ' 277' ' ' LEU . 58.3 mtt -93.35 -169.23 2.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.104 -0.498 . . . . 75.319999999999993 111.07 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.76 ' HG2' HD11 ' B' ' 285' ' ' ILE . 38.4 mt-10 69.47 13.93 8.36 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.899 -1.046 . . . . 75.319999999999993 112.311 177.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -65.48 -47.03 77.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.958 0.409 . . . . 74.549999999999997 110.073 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . 0.446 ' O ' ' HB2' ' B' ' 288' ' ' PHE . 4.3 m-85 -89.45 -5.44 57.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.508 -0.315 . . . . 73.129999999999995 111.006 174.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.76 HD11 ' HG2' ' B' ' 282' ' ' GLU . 60.8 mt -79.54 -59.79 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 110.138 -0.319 . . . . 62.210000000000001 110.138 178.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 3.1 pt-20 -65.56 -27.89 68.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.867 0.365 . . . . 73.5 110.701 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -98.52 7.09 46.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.426 -0.352 . . . . 75.040000000000006 111.054 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' B' ' 284' ' ' TYR . 76.9 t80 -64.35 -37.54 87.87 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.93 -0.767 . . . . 74.329999999999998 108.93 174.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 115.414 -0.812 . . . . 72.329999999999998 110.252 173.109 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.63 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.9 p-10 . . . . . 0 N--CA 1.452 -0.361 0 CA-C-O 121.096 0.474 . . . . 71.030000000000001 110.769 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.79 -72.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.583 -0.735 . . . . 72.400000000000006 111.111 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -120.63 -57.59 1.89 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.196 -0.456 . . . . 74.219999999999999 109.822 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.29 161.94 28.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.871 -0.604 . . . . 75.140000000000001 110.981 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.53 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -79.72 54.85 1.9 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.384 -0.826 . . . . 71.120000000000005 111.948 -179.078 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -52.14 -45.29 64.94 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.379 -0.373 . . . . 74.299999999999997 111.962 -175.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.54 -10.57 58.67 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 112.441 0.534 . . . . 73.120000000000005 112.441 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 95.5 mtt180 -91.33 -62.07 1.52 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.901 -0.407 . . . . 74.340000000000003 109.901 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.73 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -55.28 -25.03 31.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.772 0.656 . . . . 71.319999999999993 112.772 -178.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.425 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 15.1 t -64.73 -20.81 66.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.147 -0.221 . . . . 75.030000000000001 111.321 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HB2' HD11 ' B' ' 217' ' ' LEU . 39.7 mt-10 -86.22 -30.81 22.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.423 -0.584 . . . . 73.5 109.423 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.73 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.68 -47.08 82.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.168 -0.924 . . . . 75.329999999999998 109.021 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.5 HG13 ' HB1' ' B' ' 239' ' ' ALA . 72.3 mt -67.16 -29.87 47.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.483 -0.781 . . . . 74.409999999999997 110.389 175.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 12' ' ' THR . 1.2 tmmt? -64.02 -32.31 73.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 71.239999999999995 110.475 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' A' ' 17' ' ' LEU . 1.6 tm? -69.33 -43.88 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.997 -0.742 . . . . 75.530000000000001 108.997 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.8 84.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.947 -0.569 . . . . 71.540000000000006 110.694 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.521 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 8.0 m-80 -59.4 -32.89 70.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.842 -0.617 . . . . 73.409999999999997 110.944 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -73.88 -31.82 63.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 65.120000000000005 111.53 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -84.73 -22.33 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.827 0.346 . . . . 72.209999999999994 111.023 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -83.6 -0.48 50.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.275 0.56 . . . . 73.430000000000007 110.088 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.2 mm-40 -75.69 -13.69 60.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 74.140000000000001 109.814 173.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.64 HD21 HG13 ' A' ' 27' ' ' ILE . 2.0 t30 -69.2 114.98 7.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.513 -0.767 . . . . 74.319999999999993 109.681 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -62.65 -34.54 77.29 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.405 0.891 . . . . 70.030000000000001 113.405 -170.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 pm0 -90.96 1.19 57.24 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.42 -0.512 . . . . 74.420000000000002 112.175 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.64 HG13 HD21 ' A' ' 24' ' ' ASN . 7.6 mt -104.09 149.46 7.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.423 0.63 . . . . 75.140000000000001 110.158 177.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.536 ' CG ' ' HG3' ' A' ' 31' ' ' GLU . 16.8 pt20 -90.46 155.74 18.7 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.104 -0.953 . . . . 74.319999999999993 109.143 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 m -60.73 -21.51 63.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.478 0.656 . . . . 65.439999999999998 110.259 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.441 ' HA2' ' CZ ' ' B' ' 247' ' ' PHE . . . -67.15 -39.85 92.63 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.38 -0.827 . . . . 73.329999999999998 113.283 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.536 ' HG3' ' CG ' ' A' ' 28' ' ' GLN . 42.8 mt-10 -67.85 -32.03 72.27 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 117.488 0.644 . . . . 75.239999999999995 110.317 -174.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -72.68 -41.37 62.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.565 -0.743 . . . . 74.329999999999998 110.385 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -61.83 -44.73 96.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.211 0.529 . . . . 73.010000000000005 110.277 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.24 -32.55 73.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.867 -0.606 . . . . 71.530000000000001 111.031 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.528 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 48.8 m -66.0 -37.95 87.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 121.046 0.45 . . . . 72.349999999999994 109.905 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.636 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.6 t80 -63.77 -40.01 95.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.731 -0.668 . . . . 73.349999999999994 109.774 177.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.743 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.9 ttm -66.47 -46.19 77.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.609 -0.723 . . . . 73.129999999999995 111.831 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.454 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 19.9 t-105 -63.08 -36.94 85.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 75.209999999999994 110.947 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.5 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -66.44 -37.89 86.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.094 -0.503 . . . . 74.519999999999996 111.493 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.581 HD11 ' HB3' ' B' ' 236' ' ' PHE . 44.4 tp -69.98 -28.45 65.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.013 0.435 . . . . 72.400000000000006 110.375 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.553 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -63.16 -42.26 99.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.948 -0.569 . . . . 73.340000000000003 111.0 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -77.41 -28.91 52.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.923 0.392 . . . . 75.439999999999998 110.574 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -76.7 -35.13 58.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.124 -0.489 . . . . 74.430000000000007 110.574 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -77.92 -32.17 51.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.308 -0.405 . . . . 73.109999999999999 112.048 -178.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.89 -20.65 66.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.266 0.555 . . . . 62.149999999999999 110.708 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -60.13 -33.56 72.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.265 -0.879 . . . . 74.549999999999997 111.078 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.451 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.9 m-85 -77.92 -3.49 42.07 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.154 -0.475 . . . . 75.319999999999993 112.156 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.51 ' O ' ' HE1' ' A' ' 58' ' ' MET . . . -63.51 -27.48 70.94 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.163 -1.018 . . . . 73.230000000000004 110.748 173.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -65.32 -18.1 65.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.13 -0.535 . . . . 72.349999999999994 111.833 -177.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -114.69 20.33 15.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.056 0.455 . . . . 71.400000000000006 110.88 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -83.48 -59.51 2.42 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.375 -0.375 . . . . 72.019999999999996 111.586 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 4.8 m-85 -134.86 175.32 9.67 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.106 0.41 . . . . 74.450000000000003 112.106 -175.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.529 ' HG3' HG22 ' A' ' 54' ' ' THR . 10.0 pt-20 -82.37 -40.29 21.53 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.707 -0.678 . . . . 75.450000000000003 111.854 -170.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.529 HG22 ' HG3' ' A' ' 53' ' ' GLU . 80.6 p -119.65 155.48 32.25 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.865 -0.42 . . . . 52.32 109.865 -178.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 12.1 ptmm? -67.44 -26.41 66.39 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.581 -0.448 . . . . 73.420000000000002 110.418 -176.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.0 -26.83 65.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.188 -0.46 . . . . 73.239999999999995 111.038 -177.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.72 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 17.8 mt-30 -97.21 -43.54 7.31 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.521 -0.548 . . . . 75.319999999999993 109.521 175.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.574 ' HE2' HG12 ' B' ' 285' ' ' ILE . 11.2 ttt -55.31 -44.21 75.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.169 -0.923 . . . . 64.409999999999997 111.721 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.41 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 47.5 tt0 -63.9 -42.42 97.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.077 -0.511 . . . . 72.209999999999994 110.827 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.71 -2.85 18.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.028 -0.533 . . . . 75.519999999999996 111.712 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 73.4 mmtt -104.1 1.05 30.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.422 -0.354 . . . . 72.329999999999998 110.826 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.54 ' O ' ' HG3' ' A' ' 66' ' ' MET . 0.0 OUTLIER -52.93 -46.01 67.92 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 123.209 0.318 . . . . 74.400000000000006 110.809 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.486 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 9.1 tp60 -77.91 -27.96 49.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.045 0.45 . . . . 74.219999999999999 110.014 -174.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -74.17 -29.38 61.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.892 -0.594 . . . . 72.319999999999993 111.176 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 ptp -86.1 -28.08 24.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.488 -0.56 . . . . 74.450000000000003 109.488 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.629 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 86.2 mtp -75.34 -18.14 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.548 -0.751 . . . . 73.310000000000002 111.313 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.0 -31.85 73.08 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.861 0.839 . . . . 65.400000000000006 109.465 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.437 ' HD2' ' CD ' ' A' ' 72' ' ' ARG . 85.9 m-85 -93.73 -4.34 50.6 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.639 -1.164 . . . . 74.519999999999996 111.155 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.629 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.8 m-30 -86.49 -53.87 4.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.014 -1.106 . . . . 74.420000000000002 108.014 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.565 ' HE3' HD12 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -58.96 -65.43 0.67 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.999 -0.546 . . . . 64.230000000000004 111.602 175.553 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.551 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 0.1 OUTLIER -98.77 24.2 7.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.861 1.43 . . . . 74.230000000000004 114.861 -159.807 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.437 ' CD ' ' HD2' ' A' ' 68' ' ' TYR . 1.2 mmp_? -112.96 -19.92 11.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.388 -0.925 . . . . 73.010000000000005 112.997 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.642 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -88.78 5.01 45.53 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.745 -0.835 . . . . 73.129999999999995 108.745 173.251 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.538 ' HA ' ' HE1' ' B' ' 270' ' ' MET . 78.3 tttt -61.57 -57.75 10.83 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.414 -1.266 . . . . 74.030000000000001 110.519 -177.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.34 -33.68 76.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.183 -0.462 . . . . 70.209999999999994 111.708 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.485 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 44.6 mtm -74.35 -23.29 59.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.276 0.56 . . . . 75.140000000000001 110.16 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.734 ' HB3' ' HE3' ' B' ' 266' ' ' MET . 3.4 tt -76.68 -35.29 58.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.566 -0.743 . . . . 71.340000000000003 109.209 176.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.6 -37.21 77.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.054 -0.976 . . . . 62.450000000000003 111.213 -178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.37 -19.5 63.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.8 -0.636 . . . . 64.450000000000003 112.095 -178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.24 -3.51 31.32 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 74.319999999999993 111.852 -176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.483 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 24.1 mmt -85.51 -176.26 6.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.696 0.284 . . . . 74.430000000000007 110.534 175.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.748 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 63.0 -10.46 0.1 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 114.027 1.121 . . . . 74.019999999999996 114.027 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 81' ' ' MET . 10.8 t70 -56.17 -65.37 0.61 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.039 0.447 . . . . 63.520000000000003 111.381 -176.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -72.91 -13.38 61.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.29 -0.414 . . . . 72.230000000000004 110.905 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.748 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.6 mt -76.89 -54.32 13.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.431 . . . . 75.109999999999999 110.83 -176.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.2 pt-20 -68.7 -22.37 64.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.982 0.42 . . . . 73.219999999999999 111.106 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -98.57 3.34 48.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.291 -0.413 . . . . 74.219999999999999 110.878 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.449 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 73.3 t80 -64.73 -37.42 87.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.733 -0.212 . . . . 75.409999999999997 110.491 -177.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 121.584 0.707 . . . . 74.430000000000007 109.76 174.423 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.721 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 2.8 p-10 . . . . . 0 N--CA 1.449 -0.475 0 CA-C-O 121.023 0.439 . . . . 64.140000000000001 109.913 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -77.02 -76.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.995 -0.548 . . . . 64.25 110.891 -177.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -106.75 -45.31 4.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.472 0.653 . . . . 72.219999999999999 109.863 -178.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.721 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -102.18 169.33 8.79 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 73.140000000000001 111.173 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.528 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -83.77 54.25 2.82 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.833 0.853 . . . . 75.140000000000001 112.063 -177.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.525 ' CE1' ' HB1' ' B' ' 206' ' ' ALA . 29.1 m-85 -53.81 -43.54 69.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.474 . . . . 75.140000000000001 112.086 -175.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -71.34 -5.83 35.44 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.628 0.603 . . . . 63.399999999999999 112.628 -175.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -98.97 -59.97 1.62 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.906 -0.405 . . . . 73.420000000000002 109.906 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.871 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -59.35 -18.52 39.15 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.845 0.683 . . . . 72.310000000000002 112.845 -178.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.8 t -66.95 -19.62 65.75 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.131 -0.228 . . . . 61.439999999999998 111.094 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -86.67 -26.62 24.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.189 0.519 . . . . 73.450000000000003 109.894 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.871 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.45 -47.87 74.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.406 -0.815 . . . . 75.230000000000004 109.547 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.5 HG13 ' HB2' ' A' ' 39' ' ' ALA . 76.5 mt -66.3 -30.17 49.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.801 -0.636 . . . . 74.099999999999994 110.127 175.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' B' ' 216' ' ' LYS . 1.1 tmmt? -64.06 -31.85 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.575 -0.739 . . . . 71.120000000000005 111.204 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.656 HD13 HD11 ' A' ' 14' ' ' LEU . 2.8 tm? -67.86 -42.0 81.99 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.664 -0.865 . . . . 72.540000000000006 108.664 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.19 -35.8 76.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.677 -0.692 . . . . 60.130000000000003 110.719 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.427 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -63.2 -25.54 68.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.052 -0.522 . . . . 72.209999999999994 111.347 179.24 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.52 -36.26 29.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.45 -0.341 . . . . 74.329999999999998 111.304 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -74.77 -22.82 58.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.276 0.56 . . . . 73.450000000000003 110.354 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -72.65 -17.05 61.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.176 -0.92 . . . . 74.019999999999996 110.084 177.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 78.5 mm-40 -77.32 74.83 3.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.071 -0.513 . . . . 74.439999999999998 110.623 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.952 HD21 HG13 ' B' ' 227' ' ' ILE . 26.4 t30 -151.15 176.8 10.83 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.567 -0.901 . . . . 74.109999999999999 108.567 174.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.8 t -111.82 -37.94 4.99 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.397 -0.521 . . . . 74.329999999999998 112.082 -176.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -83.32 -28.02 29.35 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.171 0.434 . . . . 74.019999999999996 112.171 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.952 HG13 HD21 ' B' ' 224' ' ' ASN . 5.7 mt -76.87 151.01 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 74.319999999999993 110.257 -178.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.589 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 13.8 pm0 -101.96 157.05 17.14 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.872 -0.604 . . . . 75.450000000000003 109.487 173.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 17.8 m -58.18 -23.93 57.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.173 0.511 . . . . 63.140000000000001 110.86 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . 0.451 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.84 -35.39 91.85 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.588 -0.733 . . . . 53.119999999999997 113.199 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.589 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 14.9 mm-40 -70.16 -24.84 63.22 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 117.276 0.538 . . . . 64.219999999999999 110.342 -175.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.24 -41.47 22.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.737 -0.665 . . . . 74.319999999999993 110.289 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.0 t -62.11 -43.71 98.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 64.239999999999995 110.297 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.7 -33.02 74.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.961 -0.563 . . . . 64.420000000000002 110.983 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.405 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 50.4 m -65.54 -38.41 89.56 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.013 0.435 . . . . 62.329999999999998 110.084 179.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.584 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.4 t80 -65.24 -36.53 84.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.587 0.708 . . . . 75.439999999999998 109.501 176.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.642 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.0 ttm -66.41 -49.39 66.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.287 -0.87 . . . . 74.340000000000003 111.949 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.53 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 21.6 t-105 -62.92 -37.82 88.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 71.540000000000006 110.732 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.571 ' HB3' ' HB2' ' A' ' 11' ' ' ALA . . . -64.89 -36.87 85.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.176 -0.465 . . . . 71.430000000000007 111.304 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 54.5 tp -67.76 -33.65 75.26 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.046 0.45 . . . . 72.329999999999998 110.166 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.542 ' HB1' ' HA ' ' A' ' 77' ' ' LEU . . . -60.99 -48.17 83.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 72.129999999999995 110.988 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -67.87 -34.78 77.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.331 -0.395 . . . . 74.530000000000001 111.08 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -74.14 -38.01 63.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.074 -0.512 . . . . 74.439999999999998 110.726 -176.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -75.2 -28.39 59.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.659 0.244 . . . . 72.230000000000004 111.659 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . 0.483 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.37 -15.6 62.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.286 0.565 . . . . 53.100000000000001 110.809 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -67.05 -33.99 76.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.451 -0.795 . . . . 75.0 110.561 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.441 ' CZ ' ' HA2' ' A' ' 30' ' ' GLY . 76.8 m-85 -78.68 -0.74 31.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.57 . . . . 75.239999999999995 112.044 -176.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.542 ' O ' ' HE3' ' B' ' 258' ' ' MET . . . -56.93 -36.33 72.85 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.42 -0.895 . . . . 72.140000000000001 111.235 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 5.1 m -68.37 -11.83 60.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.469 -0.365 . . . . 54.140000000000001 111.611 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 27.1 p -105.85 1.77 27.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.964 0.411 . . . . 74.239999999999995 110.59 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 32.0 t -77.98 -43.2 30.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.952 -0.567 . . . . 64.519999999999996 111.198 -175.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.489 ' HD1' ' HG2' ' B' ' 253' ' ' GLU . 0.3 OUTLIER -144.0 -179.71 6.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.36 0.6 . . . . 71.420000000000002 112.561 -174.08 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.489 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 7.1 pt-20 -94.49 -47.53 6.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.74 -1.118 . . . . 75.150000000000006 111.872 -172.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 74.3 p -111.91 156.49 21.98 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 109.538 -0.541 . . . . 72.340000000000003 109.538 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.449 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.3 ptmt -68.02 -31.89 71.88 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.422 -0.511 . . . . 64.340000000000003 110.701 -177.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -65.98 -37.1 85.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.941 0.4 . . . . 64.319999999999993 111.044 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.5 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 26.1 mt-30 -90.55 -14.8 31.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.281 -0.418 . . . . 74.140000000000001 110.828 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.542 ' HE3' ' O ' ' B' ' 248' ' ' GLY . 17.9 ttt -89.06 -40.17 13.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.942 -0.572 . . . . 74.310000000000002 110.541 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.461 ' O ' ' HD2' ' B' ' 262' ' ' LYS . 32.8 tt0 -63.02 -34.52 77.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 75.140000000000001 110.802 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.68 -3.63 19.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.352 -0.386 . . . . 71.340000000000003 110.709 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 73.3 mmtt -115.62 -9.65 11.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.323 -0.398 . . . . 61.399999999999999 112.055 -176.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.67 ' HA ' ' HE2' ' B' ' 265' ' ' MET . 0.0 OUTLIER -64.5 -27.07 68.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 120.021 -0.671 . . . . 73.549999999999997 110.73 -173.133 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -83.36 -41.12 18.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 110.108 -0.33 . . . . 75.319999999999993 110.108 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -62.59 -42.42 99.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 75.5 111.836 -177.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.67 ' HE2' ' HA ' ' B' ' 262' ' ' LYS . 24.3 ptp -68.25 -29.84 68.75 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.085 -0.709 . . . . 73.239999999999995 109.085 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.734 ' HE3' ' HB3' ' A' ' 77' ' ' LEU . 52.5 mtp -75.86 -36.31 59.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.161 -0.927 . . . . 73.010000000000005 110.92 178.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.53 -31.76 72.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 75.519999999999996 111.001 -165.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.68 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 17.6 p90 -97.02 -11.98 23.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.222 -0.445 . . . . 75.5 110.984 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -60.48 -47.66 85.18 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 110.135 -0.32 . . . . 71.540000000000006 110.135 177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.551 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -49.68 -45.73 49.08 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.672 -0.694 . . . . 70.340000000000003 110.231 174.135 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -92.1 26.06 2.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.86 -1.064 . . . . 65.519999999999996 111.698 -169.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.68 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 3.6 mmp_? -97.87 -46.79 5.81 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.729 -0.607 . . . . 72.109999999999999 111.455 -177.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.743 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -89.64 10.78 21.88 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.329 -0.548 . . . . 74.430000000000007 110.547 -178.575 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.437 ' HE3' ' HG2' ' A' ' 70' ' ' MET . 29.4 ttmt -60.32 -53.94 51.59 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.702 -0.681 . . . . 74.450000000000003 110.454 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.52 -40.88 96.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 71.319999999999993 111.492 -176.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 60.5 mtm -73.74 -29.78 62.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 60.149999999999999 110.663 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.565 HD12 ' HE3' ' A' ' 70' ' ' MET . 4.8 tt -72.6 -43.68 63.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 75.109999999999999 109.507 177.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.522 ' HB2' ' HE2' ' A' ' 66' ' ' MET . 22.4 t70 -62.54 -27.86 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.815 -0.63 . . . . 74.109999999999999 110.821 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.4 57.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 74.040000000000006 111.548 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -95.39 -8.36 35.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.227 0.536 . . . . 75.450000000000003 110.274 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 20.6 mmt -73.74 178.06 5.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.619 -0.719 . . . . 75.310000000000002 111.226 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.709 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 40.4 mt-10 70.09 -5.22 1.34 Allowed 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 113.998 1.111 . . . . 74.349999999999994 113.998 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.28 -68.5 0.34 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.116 0.417 . . . . 73.510000000000005 110.586 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -60.4 -28.72 68.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.848 0.356 . . . . 71.349999999999994 110.832 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.709 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 61.9 mt -64.53 -55.04 23.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.564 . . . . 72.540000000000006 111.628 -176.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.7 pt-20 -63.12 -25.95 68.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.907 0.384 . . . . 75.030000000000001 111.29 -177.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -97.27 5.62 49.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.191 -0.459 . . . . 65.430000000000007 111.196 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -54.99 -52.85 61.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.648 0.24 . . . . 71.120000000000005 111.648 -176.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 . . . . . 0 C--N 1.327 -0.383 0 CA-C-O 120.638 0.256 . . . . 71.120000000000005 111.249 -177.104 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.449 -0.486 0 CA-C-O 120.921 0.391 . . . . 72.140000000000001 110.075 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.94 99.88 9.34 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 62.229999999999997 110.607 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 72.59 -60.77 0.52 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.333 -0.848 . . . . 75.219999999999999 111.537 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.1 154.55 29.28 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.892 -0.595 . . . . 53.420000000000002 111.65 -176.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.515 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -79.13 51.24 1.14 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.961 -1.018 . . . . 73.120000000000005 112.608 -175.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -54.03 -41.22 67.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.854 0.359 . . . . 75.430000000000007 111.154 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -4.77 34.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 62.009999999999998 112.361 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.442 ' NH2' ' HB3' ' B' ' 221' ' ' GLN . 60.7 mtp85 -99.86 -61.1 1.41 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.214 -0.291 . . . . 72.140000000000001 110.214 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.834 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.43 -22.49 12.73 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.77 0.656 . . . . 73.299999999999997 112.77 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.4 t -63.18 -22.71 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.706 0.289 . . . . 71.109999999999999 111.153 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.476 ' HB2' HD11 ' B' ' 217' ' ' LEU . 74.6 mt-10 -90.39 -28.08 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.075 0.464 . . . . 74.439999999999998 110.004 -178.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.8 mm? -62.39 -42.62 99.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 65.409999999999997 110.097 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.01 -23.21 21.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.506 -0.77 . . . . 73.030000000000001 111.093 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -64.22 -28.98 70.11 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 111.065 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' B' ' 213' ' ' GLU . 2.1 tm? -74.52 -43.23 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.438 -0.579 . . . . 73.409999999999997 109.438 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.28 75.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.965 -0.562 . . . . 62.439999999999998 111.416 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -66.45 -18.38 65.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.431 -0.349 . . . . 65.019999999999996 111.768 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -23.63 51.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.431 0.634 . . . . 75.319999999999993 109.864 177.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -99.23 -11.91 20.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.733 -0.667 . . . . 73.040000000000006 110.07 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.845 ' HA ' HG22 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -86.57 -21.44 26.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.495 -0.775 . . . . 63.340000000000003 110.064 -177.792 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -80.67 18.94 0.87 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.185 -0.462 . . . . 75.310000000000002 111.998 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.557 HD21 HG13 ' A' ' 27' ' ' ILE . 1.7 t30 -82.74 107.2 15.19 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.121 -1.066 . . . . 75.530000000000001 108.121 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -59.64 -32.38 70.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.807 0.669 . . . . 63.009999999999998 112.807 -171.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -91.44 11.77 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.768 0.655 . . . . 73.340000000000003 112.768 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.557 HG13 HD21 ' A' ' 24' ' ' ASN . 4.2 mt -120.52 152.07 23.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.022 0.439 . . . . 74.450000000000003 110.7 176.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.643 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 47.0 mt-30 -73.65 152.9 40.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 73.340000000000003 110.143 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.608 HG21 HD22 ' A' ' 22' ' ' ASN . 13.5 m -65.25 -34.15 77.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.206 0.527 . . . . 74.430000000000007 110.841 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.1 -2.43 78.19 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.954 -0.566 . . . . 74.150000000000006 113.708 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.643 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 52.5 mm-40 -86.47 -12.03 50.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.502 0.651 . . . . 74.310000000000002 110.246 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.845 HG22 ' HA ' ' A' ' 22' ' ' ASN . 21.3 t -91.74 -36.88 8.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.793 -0.64 . . . . 73.239999999999995 111.181 -176.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.9 p -58.65 -31.39 68.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 62.030000000000001 110.955 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.11 79.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.796 -0.638 . . . . 62.43 111.274 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.8 m -66.65 -36.38 82.42 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.123 0.487 . . . . 71.129999999999995 110.051 -178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.568 ' CD1' HD11 ' B' ' 214' ' ' LEU . 8.6 t80 -67.86 -35.54 78.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.761 -0.654 . . . . 74.200000000000003 109.509 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.571 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 11.5 ttt -66.48 -55.83 13.75 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.368 -0.833 . . . . 73.450000000000003 111.644 -178.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.613 ' CZ3' ' HB3' ' B' ' 276' ' ' MET . 16.7 t-105 -55.2 -41.1 71.53 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.283 -0.417 . . . . 74.140000000000001 111.142 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.465 ' HB3' ' HB2' ' B' ' 211' ' ' ALA . . . -60.72 -36.64 79.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.244 -0.434 . . . . 61.130000000000003 111.059 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.709 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.9 tp -69.69 -35.97 75.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 72.349999999999994 110.271 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.46 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.68 -49.92 75.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.774 -0.648 . . . . 72.519999999999996 111.306 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -80.21 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.51 -0.476 . . . . 71.230000000000004 111.297 -176.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -86.25 -39.49 16.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.402 -0.592 . . . . 75.299999999999997 109.402 175.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -72.81 -30.5 64.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 75.219999999999999 111.116 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.539 ' HA ' ' HE1' ' B' ' 281' ' ' MET . . . -72.37 -17.06 61.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 72.219999999999999 111.104 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -56.14 -38.19 70.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.846 -0.616 . . . . 73.549999999999997 110.373 177.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.543 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 69.7 m-85 -76.17 -11.31 59.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.734 -0.666 . . . . 72.219999999999999 112.072 -177.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.59 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -61.43 -33.55 85.07 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.394 -0.908 . . . . 72.409999999999997 111.484 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 60.2 p -60.76 -37.86 83.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.98 0.419 . . . . 71.209999999999994 111.493 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.6 t -95.07 13.98 23.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.149 0.5 . . . . 75.409999999999997 110.842 -175.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.1 t -76.36 -39.26 54.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 75.010000000000005 111.728 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.648 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -140.07 -167.67 2.36 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.481 -0.487 . . . . 74.549999999999997 112.258 -176.418 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.626 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.0 pt-20 -104.59 -40.33 6.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.373 -0.831 . . . . 61.149999999999999 111.686 -174.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.5 p -118.02 162.64 17.83 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.877 -0.416 . . . . 74.219999999999999 109.877 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.597 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 18.4 ptmt -71.66 -35.33 70.32 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.642 -0.423 . . . . 72.040000000000006 110.797 -177.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -64.93 -42.84 94.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.31 -0.405 . . . . 72.219999999999999 111.118 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.527 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.3 mt-30 -77.18 -36.1 55.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.886 0.374 . . . . 73.340000000000003 110.36 178.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.59 ' HE2' ' O ' ' A' ' 48' ' ' GLY . 15.9 ttt -63.25 -40.28 96.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.046 -0.525 . . . . 71.129999999999995 110.687 177.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.517 ' HA ' HD11 ' B' ' 285' ' ' ILE . 36.2 tt0 -62.11 -33.74 75.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.713 -0.676 . . . . 74.040000000000006 111.053 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.51 -1.61 38.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.353 -0.385 . . . . 75.219999999999999 111.421 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.648 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.9 mmmt -108.77 -0.38 19.98 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.408 -0.36 . . . . 73.420000000000002 111.413 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.625 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.0 ptpt -57.51 -50.81 71.86 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 123.3 0.375 . . . . 75.140000000000001 110.535 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.625 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -75.43 -14.17 60.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.428 -0.351 . . . . 75.519999999999996 110.623 -176.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -82.73 -44.86 15.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 73.5 111.431 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.424 ' CE ' ' HA ' ' A' ' 62' ' ' LYS . 3.9 ptt? -79.75 -22.49 43.17 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 119.914 -0.714 . . . . 73.140000000000001 109.617 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.592 ' HE3' ' HB2' ' B' ' 278' ' ' ASP . 56.9 mtp -89.44 -7.9 54.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.589 -0.732 . . . . 74.25 110.587 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -57.68 -45.47 85.56 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.166 0.508 . . . . 72.239999999999995 110.808 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.656 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 7.1 p90 -110.52 6.06 21.71 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.377 -0.829 . . . . 74.340000000000003 110.333 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.452 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -63.16 -53.67 49.7 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.217 -0.66 . . . . 71.549999999999997 109.217 173.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.542 ' HE1' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -55.88 -45.2 78.63 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.092 -0.706 . . . . 74.329999999999998 109.092 174.228 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.401 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 7.5 t70 -96.84 57.08 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.852 -1.067 . . . . 74.420000000000002 110.93 -173.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.656 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 7.8 mmm180 -122.29 -46.57 2.17 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 120.999 0.428 . . . . 74.439999999999998 110.648 172.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.749 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -92.25 12.56 21.98 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.49 0.662 . . . . 72.040000000000006 109.455 -178.529 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.561 ' HG3' ' SD ' ' B' ' 270' ' ' MET . 65.0 tttt -60.63 -63.82 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.463 -1.244 . . . . 75.219999999999999 110.658 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.27 -37.4 83.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.057 -0.52 . . . . 75.519999999999996 111.289 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.471 ' HB3' ' CZ3' ' B' ' 238' ' ' TRP . 47.3 mtm -69.05 -31.5 70.32 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 74.209999999999994 110.407 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.52 HD21 ' HG2' ' B' ' 266' ' ' MET . 5.6 tt -73.56 -42.14 62.04 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.549 -0.537 . . . . 65.329999999999998 109.549 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.812 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 23.1 t70 -61.53 -35.27 77.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.818 -0.628 . . . . 73.239999999999995 110.329 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.32 -13.72 62.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.444 -0.798 . . . . 64.129999999999995 111.523 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -100.61 -21.38 15.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.071 0.462 . . . . 74.040000000000006 109.759 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.52 ' O ' HG13 ' A' ' 85' ' ' ILE . 20.8 mmt -68.21 -55.73 11.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.832 -0.622 . . . . 71.219999999999999 110.18 174.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.623 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 12.5 pt-20 -57.29 -26.06 60.25 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 115.556 -0.747 . . . . 75.099999999999994 111.278 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -53.04 -48.49 67.6 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.042 0.448 . . . . 74.219999999999999 110.409 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -84.15 -25.01 29.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.152 -0.476 . . . . 73.400000000000006 110.721 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 81' ' ' MET . 67.5 mt -69.47 -56.87 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 75.109999999999999 110.919 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.1 pt-20 -68.96 -19.74 64.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 73.319999999999993 111.163 -176.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -103.95 18.88 21.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.516 -0.311 . . . . 74.129999999999995 111.174 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.462 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 21.4 t80 -56.84 -54.67 43.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.98 -0.378 . . . . 73.230000000000004 109.98 177.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.372 -0.376 . . . . 74.299999999999997 111.399 -179.357 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 109.997 -0.372 . . . . 63.009999999999998 109.997 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . 0.414 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 36.2 tt0 -78.93 81.55 5.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.129 -0.487 . . . . 71.409999999999997 110.854 -178.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 2.6 t30 72.64 -60.94 0.52 Allowed 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 124.107 0.963 . . . . 72.519999999999996 110.658 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -73.12 160.54 31.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.809 -0.632 . . . . 73.329999999999998 111.648 -176.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.483 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -82.25 49.47 1.42 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.338 -0.846 . . . . 73.140000000000001 111.805 -177.362 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.414 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 67.0 m-85 -53.21 -45.63 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.094 0.473 . . . . 70.030000000000001 110.735 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.97 -18.17 64.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.463 -0.79 . . . . 73.010000000000005 112.212 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.609 HH22 HG21 ' A' ' 32' ' ' VAL . 25.4 mtp180 -90.41 -62.27 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.156 -0.313 . . . . 63.149999999999999 110.156 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.767 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -54.16 -26.75 29.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.091 0.775 . . . . 63.409999999999997 113.091 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.5 t -65.58 -18.32 65.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.509 0.195 . . . . 75.310000000000002 111.188 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 21.2 mt-10 -96.49 -16.73 20.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.062 0.458 . . . . 74.409999999999997 110.391 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.767 HD22 ' HA ' ' B' ' 211' ' ' ALA . 3.9 mm? -69.11 -45.01 71.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.888 -0.782 . . . . 73.5 108.888 173.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.452 HG13 ' HB1' ' A' ' 39' ' ' ALA . 66.7 mt -69.2 -24.85 28.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.394 -0.821 . . . . 74.319999999999993 110.339 175.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.515 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.7 tmtp? -59.69 -35.71 75.03 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.678 -0.692 . . . . 72.329999999999998 110.709 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.722 HD13 HD11 ' A' ' 14' ' ' LEU . 3.0 tm? -71.41 -42.35 68.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.185 -0.672 . . . . 74.530000000000001 109.185 176.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.59 -39.07 86.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 75.230000000000004 111.04 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -61.22 -33.77 74.03 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.849 0.357 . . . . 74.310000000000002 111.074 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -34.78 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 74.209999999999994 110.459 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . 0.442 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 56.3 mt-30 -82.77 -17.34 44.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.364 0.602 . . . . 73.329999999999998 110.255 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . 0.674 HD22 HG22 ' B' ' 229' ' ' THR . 25.5 t-20 -76.25 -5.47 47.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.154 -0.93 . . . . 75.329999999999998 109.779 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -77.41 2.37 16.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 73.209999999999994 111.356 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.7 131.99 52.54 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.099 0.476 . . . . 74.450000000000003 110.262 175.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.8 t -94.69 -22.96 17.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.834 -0.621 . . . . 73.430000000000007 110.063 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . 0.43 ' HG2' HG13 ' B' ' 227' ' ' ILE . 1.5 pm0 -88.73 -21.82 23.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.65 -0.704 . . . . 72.439999999999998 111.455 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.43 HG13 ' HG2' ' B' ' 226' ' ' GLU . 6.3 mt -110.01 150.95 12.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.873 0.368 . . . . 75.420000000000002 110.619 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -93.44 175.56 6.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.836 -0.62 . . . . 74.0 110.193 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 229' ' ' THR . . . . . 0.674 HG22 HD22 ' B' ' 222' ' ' ASN . 3.4 m -64.29 -31.56 72.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.156 -0.474 . . . . 75.129999999999995 111.588 -175.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . 0.543 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -61.5 -25.62 65.41 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 114.865 0.706 . . . . 71.5 114.865 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -88.06 -15.99 34.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.697 0.748 . . . . 63.420000000000002 111.635 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . 0.511 HG21 ' HA ' ' B' ' 222' ' ' ASN . 35.9 t -81.11 -37.4 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.963 -0.295 . . . . 74.129999999999995 110.896 -176.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 8.7 p -60.25 -34.64 73.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.286 0.565 . . . . 65.129999999999995 110.567 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.11 -32.02 72.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.751 . . . . 71.450000000000003 111.635 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 18.3 m -67.64 -32.81 73.76 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.137 0.494 . . . . 71.409999999999997 109.738 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.636 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 4.7 t80 -71.91 -34.81 69.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 74.329999999999998 109.239 177.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.749 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.9 tpt -60.41 -55.81 29.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 74.010000000000005 110.916 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.515 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 28.3 t-105 -63.87 -33.8 76.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.73 -0.668 . . . . 75.549999999999997 111.739 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.462 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -64.99 -39.61 93.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.597 -0.274 . . . . 71.230000000000004 111.16 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.456 HD21 ' HG3' ' A' ' 37' ' ' MET . 61.6 tp -68.19 -29.94 68.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.931 0.396 . . . . 74.340000000000003 110.416 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.09 -47.47 82.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.933 -0.576 . . . . 64.140000000000001 111.303 -178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -84.01 -5.97 59.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.846 -0.342 . . . . 73.010000000000005 110.902 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -89.37 -41.03 12.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.231 -0.655 . . . . 74.109999999999999 109.231 175.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -75.18 -36.73 61.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.791 -0.64 . . . . 72.239999999999995 111.761 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -68.01 -17.14 64.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.061 0.457 . . . . 71.340000000000003 111.021 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -68.05 -17.82 64.51 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 74.519999999999996 110.009 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -96.71 -0.06 48.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.124 -0.489 . . . . 75.040000000000006 111.206 177.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.44 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -75.8 -29.77 58.78 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.6 -0.81 . . . . 64.209999999999994 111.671 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 18.6 p -72.11 -18.12 61.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.865 0.365 . . . . 72.409999999999997 111.235 -177.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 15.3 t -103.95 16.79 25.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.538 0.685 . . . . 74.319999999999993 110.117 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 10.6 t -82.06 -44.21 16.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.585 -0.734 . . . . 72.200000000000003 110.329 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.722 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 0.4 OUTLIER -138.94 -172.37 3.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.471 -0.331 . . . . 74.340000000000003 111.159 -179.602 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -102.96 -44.57 5.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.109999999999999 111.592 -173.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 56.4 p -107.33 151.63 25.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.72 -0.218 . . . . 73.209999999999994 110.551 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.462 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 22.5 ptmt -63.27 -32.51 73.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.4 . . . . 73.109999999999999 110.636 -178.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -60.14 -54.17 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.859 -0.609 . . . . 75.219999999999999 110.299 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.647 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 22.3 mt-30 -71.4 -42.88 67.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.838 -0.619 . . . . 73.019999999999996 110.363 -178.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.44 ' HE2' ' O ' ' B' ' 248' ' ' GLY . 14.5 ttt -57.27 -42.06 80.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 72.439999999999998 111.233 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -63.23 -33.02 74.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.061 -0.518 . . . . 72.519999999999996 111.245 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -78.3 -4.51 48.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.992 0.425 . . . . 62.030000000000001 111.061 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.722 ' HE2' ' HE2' ' B' ' 252' ' ' PHE . 27.1 mmmt -112.91 3.83 16.51 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.156 -176.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.649 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 17.3 ptpt -55.86 -52.97 62.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.073 -0.512 . . . . 71.230000000000004 110.647 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.649 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.0 tp60 -66.57 -30.55 70.88 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.529 -0.305 . . . . 71.540000000000006 110.789 -176.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.437 -0.347 . . . . 75.120000000000005 111.53 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.504 ' CE ' ' HA ' ' B' ' 262' ' ' LYS . 4.8 ptt? -79.47 -28.13 41.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 120.274 -0.57 . . . . 72.230000000000004 110.191 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.812 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 72.8 mtp -77.32 -24.24 50.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.718 -0.674 . . . . 74.299999999999997 111.613 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -66.19 -25.95 67.17 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.53 0.681 . . . . 62.109999999999999 109.214 -174.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.427 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 28.1 m-85 -94.29 -17.24 22.83 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.893 -1.048 . . . . 74.200000000000003 111.35 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.476 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.5 m-30 -72.55 -40.45 66.7 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.247 -1.02 . . . . 75.109999999999999 108.247 171.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.561 ' SD ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.75 -63.61 1.09 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.033 -0.531 . . . . 74.209999999999994 110.386 169.701 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . 0.409 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 24.5 t0 -98.84 76.87 2.19 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.742 0.645 . . . . 74.109999999999999 112.742 -169.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 4.5 mmm180 -152.87 -34.49 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.955 -0.566 . . . . 74.019999999999996 111.081 166.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.571 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.84 0.66 46.62 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 108.988 -0.745 . . . . 74.230000000000004 108.988 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.542 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 80.1 tttt -61.29 -52.58 64.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.806 -1.088 . . . . 75.319999999999993 110.827 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -58.91 -38.74 79.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.192 0.52 . . . . 73.519999999999996 111.129 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 276' ' ' MET . . . . . 0.613 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 55.2 mtm -80.34 -24.69 39.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.836 -0.62 . . . . 64.129999999999995 110.427 -177.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.483 HD21 ' HG2' ' A' ' 66' ' ' MET . 4.9 tt -72.42 -43.45 63.84 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.814 -0.81 . . . . 74.420000000000002 108.814 174.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.592 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 11.2 t70 -56.93 -39.85 75.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.085 -0.962 . . . . 64.439999999999998 110.291 177.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -61.91 -24.03 66.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.091 -0.958 . . . . 73.329999999999998 112.008 -177.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -98.4 -13.98 20.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.913 0.387 . . . . 64.030000000000001 110.516 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.539 ' HE1' ' HA ' ' A' ' 45' ' ' ALA . 16.1 mmt -69.66 -55.21 10.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.934 -0.575 . . . . 74.409999999999997 110.786 178.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 7.3 pt-20 -78.61 0.76 25.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.942 -0.572 . . . . 64.549999999999997 112.495 -174.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.73 -45.92 92.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.278 0.561 . . . . 71.209999999999994 109.601 173.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -82.37 -19.72 38.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.543 -0.753 . . . . 72.420000000000002 110.471 177.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.538 ' CG1' ' HA ' ' B' ' 282' ' ' GLU . 68.6 mt -71.87 -55.29 13.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 120.905 0.384 . . . . 74.310000000000002 110.572 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -65.78 -18.53 65.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 74.430000000000007 110.937 -178.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . 0.404 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 57.8 m-80 -112.32 18.9 18.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.446 -0.343 . . . . 75.430000000000007 111.462 179.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.597 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 26.4 t80 -53.59 -54.6 35.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.699 0.285 . . . . 75.310000000000002 110.833 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.329 -0.396 . . . . 71.239999999999995 111.246 -178.481 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 CA--C 1.519 -0.216 0 N-CA-C 110.083 -0.34 . . . . 71.329999999999998 110.083 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.552 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . 3.3 tm-20 -65.28 -43.96 89.54 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.314 -0.995 . . . . 72.430000000000007 108.314 169.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.618 ' H ' ' HE2' ' A' ' 8' ' ' TYR . 9.1 t30 -148.04 -30.33 0.3 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.906 -1.043 . . . . 64.329999999999998 109.767 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.46 -162.75 1.62 Allowed 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 112.511 0.56 . . . . 72.340000000000003 112.511 -173.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.457 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.6 OUTLIER -71.58 42.33 0.08 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.097 1.359 . . . . 72.109999999999999 114.312 -172.396 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.618 ' HE2' ' H ' ' A' ' 5' ' ' ASN . 75.2 m-85 -57.9 -41.5 82.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 118.009 0.368 . . . . 73.340000000000003 111.469 -176.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.46 -18.96 65.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 64.400000000000006 111.913 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -92.93 -52.8 4.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.525 0.194 . . . . 75.340000000000003 111.525 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.753 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -54.6 -25.02 23.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.552 0.575 . . . . 73.409999999999997 112.552 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.9 t -68.13 -23.0 64.84 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.674 0.273 . . . . 74.420000000000002 111.028 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.572 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.3 mt-10 -79.19 -27.22 42.59 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.361 0.6 . . . . 75.310000000000002 109.392 -178.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.753 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -65.75 -48.98 70.04 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.033 -0.985 . . . . 75.109999999999999 109.597 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.516 HG21 ' HD2' ' B' ' 243' ' ' TYR . 81.4 mt -67.82 -29.44 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.587 -0.733 . . . . 63.520000000000003 110.198 176.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.432 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.3 tmmt? -60.18 -30.5 69.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.732 -0.667 . . . . 72.349999999999994 111.023 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.401 HD13 HD12 ' B' ' 214' ' ' LEU . 3.0 tm? -69.32 -45.23 70.01 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.29 -0.633 . . . . 74.430000000000007 109.29 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -32.27 72.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.636 -0.711 . . . . 70.040000000000006 110.921 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.6 m-20 -56.01 -35.72 67.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.071 -0.513 . . . . 74.430000000000007 110.624 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.54 -37.95 65.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 72.430000000000007 111.122 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -74.13 -22.36 59.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.918 0.389 . . . . 74.439999999999998 110.849 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -79.71 -12.71 59.79 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.185 0.517 . . . . 74.519999999999996 109.872 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 78.1 mm-40 -81.9 -4.85 57.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.97 -0.559 . . . . 74.219999999999999 110.328 175.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.578 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.6 t30 -80.03 135.01 36.26 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.256 0.55 . . . . 75.200000000000003 110.61 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -74.98 -36.39 62.03 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.228 -0.896 . . . . 72.439999999999998 111.84 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.58 -23.56 56.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 74.349999999999994 111.602 -174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.578 HG13 ' HB3' ' A' ' 24' ' ' ASN . 2.5 mt -97.12 163.43 2.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.867 0.365 . . . . 71.439999999999998 110.262 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -119.8 163.52 17.37 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.845 -0.616 . . . . 73.319999999999993 109.392 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -54.65 -32.21 58.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.933 0.397 . . . . 73.340000000000003 111.509 -176.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.54 -42.21 99.72 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.232 -0.508 . . . . 73.409999999999997 113.473 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.407 ' HB2' HG21 ' A' ' 27' ' ' ILE . 21.0 mm-40 -73.04 -37.82 66.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.127 0.463 . . . . 72.109999999999999 111.221 -173.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -69.12 -36.99 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.193 0.52 . . . . 73.349999999999994 110.657 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 m -74.94 -40.01 61.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.091 0.472 . . . . 73.230000000000004 110.705 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.95 -30.33 63.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 73.219999999999999 111.867 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.486 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 11.0 p -66.98 -30.75 70.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.6 0.238 . . . . 74.0 110.727 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.548 ' CD1' HD13 ' B' ' 214' ' ' LEU . 4.9 t80 -66.16 -33.58 76.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.16 0.505 . . . . 63.310000000000002 109.772 177.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.525 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.8 ttm -70.54 -47.49 60.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.861 -0.609 . . . . 74.129999999999995 111.104 178.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -63.3 -37.89 89.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.931 0.396 . . . . 72.340000000000003 110.616 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.405 ' HB3' HG13 ' B' ' 215' ' ' ILE . . . -65.95 -36.8 84.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 111.196 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.593 HD23 ' SD ' ' B' ' 237' ' ' MET . 52.3 tp -66.62 -32.4 73.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.001 0.429 . . . . 73.439999999999998 110.022 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.447 ' HA ' HD11 ' B' ' 277' ' ' LEU . . . -66.91 -46.25 75.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.795 -0.639 . . . . 63.240000000000002 110.704 177.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.3 mtp180 -69.05 -25.11 64.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.896 0.379 . . . . 75.439999999999998 110.949 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -84.29 -45.03 13.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 73.099999999999994 111.057 -177.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -68.51 -28.39 66.96 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.081 0.4 . . . . 71.409999999999997 112.081 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.14 60.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.998 0.428 . . . . 73.109999999999999 111.054 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -66.94 -17.67 65.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.639 0.733 . . . . 72.299999999999997 110.047 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.431 ' CZ ' HG22 ' B' ' 229' ' ' THR . 83.0 m-85 -93.3 0.32 56.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.761 -0.654 . . . . 71.299999999999997 111.156 177.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.451 ' C ' ' HE3' ' A' ' 58' ' ' MET . . . -73.46 -37.05 53.92 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.454 -0.879 . . . . 61.520000000000003 111.323 176.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -73.03 -0.21 13.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.954 0.407 . . . . 74.230000000000004 111.574 -177.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.7 t -123.53 17.55 9.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.338 0.59 . . . . 73.430000000000007 109.486 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.9 t -93.93 -31.43 14.29 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.813 -0.63 . . . . 63.509999999999998 110.867 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.694 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -143.29 -174.29 4.17 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 120.947 0.403 . . . . 75.120000000000005 111.368 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.621 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 7.7 pt-20 -98.54 -41.4 7.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.573 -0.74 . . . . 74.099999999999994 111.383 -173.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 82.7 p -120.93 161.84 20.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.094 -0.336 . . . . 74.430000000000007 110.094 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.441 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 22.2 ptmt -72.88 -34.57 66.78 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.918 -0.313 . . . . 74.230000000000004 110.538 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.14 -31.99 73.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.168 -0.469 . . . . 71.430000000000007 110.386 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.644 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 20.2 mt-30 -90.48 -37.72 13.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.007 -0.542 . . . . 73.150000000000006 110.464 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.451 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 10.5 ttt -61.81 -42.41 98.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.288 -0.414 . . . . 74.400000000000006 110.988 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.85 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.001 -0.545 . . . . 70.129999999999995 110.991 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.07 -6.73 58.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 61.009999999999998 111.27 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.694 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 30.2 mmmt -108.56 4.37 23.99 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 116.486 -0.325 . . . . 73.409999999999997 110.79 -178.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.632 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 18.3 ptpt -53.72 -45.05 70.35 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.338 0.399 . . . . 75.420000000000002 111.017 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.431 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 8.5 tp60 -79.9 -14.18 58.82 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.882 -0.327 . . . . 64.209999999999994 110.654 -176.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -93.37 -6.67 46.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.393 -0.367 . . . . 72.230000000000004 110.929 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.632 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 20.5 ptp -106.39 -25.05 12.07 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.323 -0.621 . . . . 74.319999999999993 109.323 169.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.509 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 82.2 mtp -94.02 -0.47 55.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.449 -0.796 . . . . 65.349999999999994 112.498 -175.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.26 -33.08 59.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.7 0.762 . . . . 72.230000000000004 109.34 -175.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.641 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 10.8 m-85 -84.27 -16.14 44.21 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.754 -1.112 . . . . 75.230000000000004 110.913 175.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.637 ' O ' ' HE2' ' B' ' 237' ' ' MET . 13.8 m-30 -73.66 -42.21 61.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.263 -0.426 . . . . 73.109999999999999 109.981 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.732 ' HE2' HD22 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -74.72 -56.71 4.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.279 -0.569 . . . . 63.25 109.804 170.485 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -102.67 83.73 2.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.09 -0.504 . . . . 72.219999999999999 112.354 -171.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.641 ' HB2' ' O ' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -164.16 -36.93 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.092 -0.504 . . . . 75.109999999999999 111.059 169.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.564 ' HB3' ' HE3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -86.87 7.84 25.5 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.834 0.826 . . . . 74.230000000000004 108.838 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.412 ' HE2' HE22 ' B' ' 263' ' ' GLN . 47.6 tttm -62.64 -54.52 38.33 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.318 -1.31 . . . . 75.109999999999999 110.172 175.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -58.92 -35.57 73.3 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.147 -0.479 . . . . 73.340000000000003 110.625 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.406 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 50.6 mtt -67.28 -36.75 82.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.617 -0.719 . . . . 74.010000000000005 109.974 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.774 ' HB3' ' HE2' ' B' ' 266' ' ' MET . 0.9 OUTLIER -75.47 -40.9 56.8 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.264 -0.88 . . . . 74.140000000000001 110.224 -178.442 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -53.71 -38.94 64.78 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.315 0.579 . . . . 72.209999999999994 110.175 174.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -31.57 71.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.038 -0.983 . . . . 64.140000000000001 111.523 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.488 HD22 ' HG2' ' B' ' 242' ' ' ARG . 42.8 m-80 -85.09 -32.5 22.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.741 -0.466 . . . . 75.530000000000001 109.741 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.502 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.6 mmt -62.39 -62.17 1.94 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 65.430000000000007 110.475 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 24.6 mm-40 -54.1 -31.7 52.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 72.530000000000001 111.334 -178.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.45 -46.44 80.34 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.346 0.404 . . . . 60.009999999999998 111.328 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -82.53 -28.98 30.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 60.350000000000001 110.695 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.516 HG22 ' HB2' ' B' ' 259' ' ' GLN . 87.3 mt -67.91 -53.48 30.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 71.439999999999998 111.549 -178.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.4 pt-20 -65.32 -25.69 67.72 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.788 0.328 . . . . 73.319999999999993 111.093 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.8 m-80 -102.83 14.94 30.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.553 -0.294 . . . . 72.349999999999994 111.212 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.536 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 62.1 t80 -53.24 -53.83 45.08 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.025 0.203 . . . . 75.349999999999994 111.328 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--N 1.326 -0.448 0 CA-C-O 120.834 0.349 . . . . 73.040000000000006 110.329 -177.06 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 110.661 -0.125 . . . . 75.140000000000001 110.661 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.02 -70.09 0.21 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.484 -0.562 . . . . 65.340000000000003 109.484 170.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -142.56 9.6 1.81 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.903 0.859 . . . . 72.219999999999999 109.124 174.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.556 ' HB2' ' CE2' ' B' ' 208' ' ' TYR . . . -124.58 170.37 10.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 74.530000000000001 111.875 -171.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.486 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -86.59 38.04 0.77 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.423 -0.808 . . . . 75.129999999999995 112.061 -175.64 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.556 ' CE2' ' HB2' ' B' ' 206' ' ' ALA . 65.0 m-85 -52.63 -55.71 20.54 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.687 0.254 . . . . 72.329999999999998 111.687 -177.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.69 -18.46 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.066 -0.515 . . . . 70.209999999999994 112.338 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -86.79 -54.49 4.33 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.146 -0.222 . . . . 73.25 110.662 178.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.612 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -55.1 -28.32 51.68 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.432 0.53 . . . . 74.25 112.432 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 12.5 t -70.34 -16.4 62.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 120.759 -0.376 . . . . 64.129999999999995 111.264 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 36.8 mt-10 -82.96 -29.23 29.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.837 -0.801 . . . . 75.519999999999996 108.837 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.612 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.0 -44.8 79.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.903 -1.044 . . . . 75.420000000000002 108.95 176.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.405 HG13 ' HB3' ' A' ' 39' ' ' ALA . 73.0 mt -69.62 -27.39 33.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.39 -0.823 . . . . 65.109999999999999 110.512 177.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.461 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.0 OUTLIER -57.52 -38.63 74.99 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.259 -0.428 . . . . 65.439999999999998 110.982 -179.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -70.16 -42.59 72.31 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.224 -0.658 . . . . 73.239999999999995 109.224 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . 0.467 ' O ' HG12 ' B' ' 232' ' ' VAL . . . -60.03 -42.43 94.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.058 -0.519 . . . . 64.239999999999995 110.731 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.559 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.4 m-20 -56.24 -34.22 66.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.235 -0.439 . . . . 70.329999999999998 110.587 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.33 -34.08 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.007 -0.542 . . . . 73.349999999999994 111.297 -178.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -75.39 -25.91 58.01 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.213 0.53 . . . . 72.219999999999999 110.495 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . 0.419 ' HA ' HG22 ' B' ' 232' ' ' VAL . 2.9 t-20 -68.27 -21.4 64.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.51 -0.768 . . . . 72.129999999999995 109.125 177.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 60.1 mm-40 -85.32 0.68 51.27 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.383 -0.826 . . . . 73.230000000000004 111.077 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.703 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 33.5 t30 -78.01 123.15 26.48 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 109.691 -0.485 . . . . 74.019999999999996 109.691 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.3 t -54.98 -26.01 33.77 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.91 -1.041 . . . . 74.439999999999998 113.434 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -105.08 9.05 34.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.381 0.512 . . . . 73.319999999999993 112.381 -173.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.703 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 6.2 mm -108.16 152.14 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.397 0.618 . . . . 75.239999999999995 111.306 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.539 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 32.8 mt-30 -92.11 152.13 20.07 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.143 -0.935 . . . . 75.519999999999996 108.596 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 229' ' ' THR . . . . . 0.431 HG22 ' CZ ' ' A' ' 47' ' ' PHE . 16.8 m -56.46 -38.22 71.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.922 0.392 . . . . 72.209999999999994 110.755 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.28 -0.18 76.78 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.216 -0.516 . . . . 72.239999999999995 113.964 -176.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.539 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 42.1 mt-10 -90.02 -27.42 19.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.862 0.831 . . . . 71.510000000000005 110.406 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . 0.467 HG12 ' O ' ' B' ' 218' ' ' ALA . 12.1 t -76.94 -23.94 15.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.741 -0.663 . . . . 75.200000000000003 110.682 -176.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.5 p -77.46 -32.61 54.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.368 0.604 . . . . 52.039999999999999 109.806 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.71 65.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.529 -0.759 . . . . 63.200000000000003 111.044 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.457 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 16.8 p -66.86 -37.11 83.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.706 0.288 . . . . 75.310000000000002 110.334 177.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.551 ' CD1' HD13 ' A' ' 14' ' ' LEU . 2.7 t80 -67.13 -37.71 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.424 0.631 . . . . 70.340000000000003 109.323 175.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.637 ' HE2' ' O ' ' A' ' 69' ' ' TYR . 10.7 tpt -58.07 -59.77 4.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.924 -1.034 . . . . 54.149999999999999 111.006 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.406 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 13.6 t-105 -59.43 -37.14 77.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 75.209999999999994 111.593 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.414 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -64.19 -39.08 93.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.374 -0.375 . . . . 71.129999999999995 111.34 -178.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.499 HD13 ' HB3' ' A' ' 36' ' ' PHE . 53.7 tp -68.77 -33.52 74.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.29 -0.263 . . . . 75.420000000000002 110.29 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.51 -35.42 75.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 71.239999999999995 111.104 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . 0.488 ' HG2' HD22 ' A' ' 80' ' ' ASN . 34.5 mtp180 -80.44 -45.87 16.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.181 -0.463 . . . . 75.450000000000003 110.742 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.516 ' HD2' HG21 ' A' ' 15' ' ' ILE . 12.2 t80 -68.52 -40.32 80.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.112 -0.495 . . . . 73.010000000000005 111.315 -174.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -64.73 -35.09 79.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.159 0.504 . . . . 75.209999999999994 110.931 -175.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -68.4 -2.04 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.871 -0.604 . . . . 71.319999999999993 112.242 -177.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -64.16 -26.92 68.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.218 0.532 . . . . 74.129999999999995 110.115 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -81.76 -5.27 58.0 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.134 -0.354 . . . . 75.319999999999993 111.13 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.433 ' O ' ' HE3' ' B' ' 258' ' ' MET . . . -71.03 -40.55 62.1 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.643 -0.789 . . . . 65.109999999999999 111.999 178.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 4.5 p -70.04 -14.25 62.59 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.869 0.322 . . . . 61.310000000000002 111.869 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.0 t -111.19 19.68 18.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.364 0.602 . . . . 72.219999999999999 110.022 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 8.2 t -84.94 -43.79 13.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.032 -0.531 . . . . 72.439999999999998 111.29 -176.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.559 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -143.2 -177.65 5.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.362 0.601 . . . . 75.140000000000001 112.353 -176.01 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.481 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 9.6 pt-20 -92.32 -37.03 12.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.973 -1.012 . . . . 74.329999999999998 111.832 -171.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.7 p -126.47 161.28 28.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.38 -0.23 . . . . 62.509999999999998 110.38 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.536 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 17.0 ptmt -64.14 -39.02 93.12 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 71.239999999999995 111.067 -177.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' B' ' 255' ' ' LYS . 37.1 mt-10 -59.89 -47.4 85.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.088 0.471 . . . . 75.239999999999995 111.026 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.658 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.8 mt-30 -80.48 -30.04 37.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.967 -0.56 . . . . 63.329999999999998 110.421 -176.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.433 ' HE3' ' O ' ' B' ' 248' ' ' GLY . 14.0 ttt -67.03 -45.04 78.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 73.430000000000007 110.398 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.516 ' HB2' HG22 ' A' ' 85' ' ' ILE . 33.2 tt0 -63.03 -32.55 73.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.701 -0.681 . . . . 74.5 111.064 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -72.9 -11.33 60.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.178 -0.464 . . . . 74.239999999999995 111.055 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -107.1 -4.13 19.22 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 110.059 -0.348 . . . . 74.120000000000005 110.059 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.533 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 36.4 ttpt -52.3 -56.29 15.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.761 -0.654 . . . . 65.219999999999999 110.686 -177.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.412 HE22 ' HE2' ' A' ' 74' ' ' LYS . 15.2 tp60 -64.74 -30.92 71.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 75.209999999999994 111.004 -178.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -70.12 -45.48 66.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.329 -0.396 . . . . 74.219999999999999 111.909 -176.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.533 ' CE ' ' HA ' ' B' ' 262' ' ' LYS . 3.0 ptt? -77.73 -24.43 49.12 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 119.734 -0.786 . . . . 55.340000000000003 109.542 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.774 ' HE2' ' HB3' ' A' ' 77' ' ' LEU . 84.5 mtp -79.61 -13.39 59.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.591 -0.731 . . . . 71.219999999999999 111.431 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.17 -30.07 69.1 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.484 -0.932 . . . . 72.030000000000001 108.484 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 21.8 m-85 -93.7 -10.22 35.12 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.332 -1.304 . . . . 75.209999999999994 111.486 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.466 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 20.2 m-30 -79.82 -40.73 27.91 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.281 -1.007 . . . . 75.439999999999998 108.281 172.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.462 ' N ' ' HE1' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.7 -59.01 3.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.087 -0.506 . . . . 65.450000000000003 110.199 170.026 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.16 83.65 2.0 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.168 0.433 . . . . 75.400000000000006 112.168 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 9.7 mmm180 -154.04 -30.02 0.12 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.972 -0.558 . . . . 72.219999999999999 110.903 166.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.525 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -90.52 6.44 43.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.619 -0.882 . . . . 75.099999999999994 108.619 177.039 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.415 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 85.2 tttt -61.82 -53.5 55.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.564 -1.198 . . . . 74.219999999999999 110.248 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -69.41 -33.61 73.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.055 -0.52 . . . . 73.400000000000006 110.9 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.0 mtt -61.62 -38.93 89.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.608 0.718 . . . . 74.450000000000003 109.706 173.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.732 HD22 ' HE2' ' A' ' 70' ' ' MET . 22.6 tp -71.37 -46.07 61.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.687 -1.142 . . . . 74.140000000000001 110.786 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.96 -40.23 80.07 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.271 0.558 . . . . 75.409999999999997 110.486 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.54 -30.72 71.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.156 -0.929 . . . . 74.030000000000001 111.196 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -86.31 -29.26 23.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 74.019999999999996 110.508 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.573 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -61.26 -55.42 32.11 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.879 -0.415 . . . . 75.400000000000006 109.879 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.608 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 71.7 mm-40 -52.98 -30.63 36.16 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.515 -0.766 . . . . 65.420000000000002 111.799 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -54.52 -51.36 65.39 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.396 0.435 . . . . 72.219999999999999 111.133 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -80.22 -28.65 38.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.356 -0.384 . . . . 75.310000000000002 111.156 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.573 HG13 ' O ' ' B' ' 281' ' ' MET . 76.3 mt -63.98 -53.56 42.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.823 0.344 . . . . 60.329999999999998 110.895 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.9 pt-20 -63.18 -29.01 70.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.42 -0.355 . . . . 73.010000000000005 111.201 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . 0.448 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 61.6 m-80 -102.02 15.37 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.528 -0.305 . . . . 71.099999999999994 111.417 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.441 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 27.0 t80 -53.22 -57.6 9.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.683 0.278 . . . . 73.519999999999996 111.02 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 28.0 t70 . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.297 -0.41 . . . . 70.150000000000006 110.583 -175.985 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.672 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.3 p-10 . . . . . 0 N--CA 1.452 -0.368 0 CA-C-O 121.054 0.454 . . . . 71.140000000000001 110.767 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -83.51 -80.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.993 -0.549 . . . . 74.019999999999996 110.169 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -105.16 -53.74 2.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.07 0.462 . . . . 74.430000000000007 109.94 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.672 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -82.52 161.9 22.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.895 -0.593 . . . . 71.200000000000003 110.808 177.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.473 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -80.41 55.14 2.19 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.895 -0.593 . . . . 73.420000000000002 112.181 -178.252 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -53.02 -42.65 65.86 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.334 -0.394 . . . . 74.329999999999998 111.844 -176.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' HG21 ' A' ' 12' ' ' THR . . . -63.35 -28.39 69.97 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.136 0.421 . . . . 72.099999999999994 112.136 -176.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -80.81 -62.98 1.51 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 121.174 -0.21 . . . . 74.510000000000005 110.608 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.541 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.91 -22.41 10.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.778 0.659 . . . . 71.030000000000001 112.778 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.428 HG21 ' O ' ' A' ' 9' ' ' ALA . 1.9 t -70.02 -25.82 63.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.464 0.173 . . . . 72.120000000000005 110.992 -176.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.468 ' CB ' HD11 ' B' ' 217' ' ' LEU . 29.9 mt-10 -76.73 -35.5 57.74 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.373 0.606 . . . . 72.420000000000002 109.401 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.64 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.0 mm? -61.11 -49.81 75.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.612 -1.176 . . . . 74.340000000000003 109.694 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.705 HG23 ' HD1' ' B' ' 243' ' ' TYR . 91.2 mt -63.36 -39.84 86.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.616 -0.72 . . . . 72.219999999999999 110.858 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 tmmt? -62.02 -31.37 71.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.618 -0.719 . . . . 74.0 111.516 -176.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.508 HD11 HD12 ' B' ' 214' ' ' LEU . 3.0 tm? -64.68 -42.54 95.28 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.981 -0.748 . . . . 73.010000000000005 108.981 177.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.435 ' HB2' HG13 ' A' ' 32' ' ' VAL . . . -62.72 -30.79 71.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.403 -0.817 . . . . 73.439999999999998 110.948 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.417 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -62.57 -35.26 78.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.212 -0.449 . . . . 75.310000000000002 110.749 179.437 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -70.57 -23.25 62.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.197 -0.456 . . . . 71.030000000000001 111.23 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -88.17 -27.29 21.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.247 0.546 . . . . 75.209999999999994 110.351 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.26 0.51 24.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 73.150000000000006 110.33 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 48.8 mt-30 -77.46 -11.81 59.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 75.019999999999996 111.197 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.449 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.8 t30 -66.04 114.14 4.98 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.462 -0.57 . . . . 75.109999999999999 109.462 178.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.8 t -77.45 58.06 1.64 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.318 -0.856 . . . . 75.150000000000006 112.272 -172.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -178.0 -22.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 75.230000000000004 111.441 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.449 HG13 ' HB3' ' A' ' 24' ' ' ASN . 9.7 mt -84.36 148.77 4.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 72.450000000000003 110.31 -177.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.685 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -72.76 145.38 47.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 74.519999999999996 109.704 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.0 m -63.39 -25.26 68.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.252 0.549 . . . . 75.340000000000003 109.843 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.03 -17.37 78.59 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 115.462 -0.79 . . . . 73.409999999999997 112.823 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.685 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 16.3 mm-40 -79.04 -22.62 45.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.417 0.627 . . . . 74.019999999999996 109.567 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.435 HG13 ' HB2' ' A' ' 18' ' ' ALA . 21.8 t -83.53 -42.44 17.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.417 -0.811 . . . . 74.329999999999998 110.088 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 p -62.1 -35.94 80.22 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.988 0.423 . . . . 73.140000000000001 110.177 176.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.13 -33.33 75.75 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.978 -0.555 . . . . 75.409999999999997 110.786 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.7 m -68.46 -36.35 78.88 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.509 -0.552 . . . . 72.519999999999996 109.509 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.64 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.7 t80 -69.94 -35.05 74.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.472 -0.785 . . . . 74.129999999999995 109.49 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.983 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.8 tpt -62.35 -56.79 14.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.08 -0.964 . . . . 73.030000000000001 110.563 179.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.406 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.637 -0.71 . . . . 74.319999999999993 111.335 177.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.42 ' HB3' HG13 ' B' ' 215' ' ' ILE . . . -62.36 -42.05 99.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.404 -0.362 . . . . 63.340000000000003 111.102 -179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.527 HD23 ' HE2' ' B' ' 237' ' ' MET . 52.1 tp -62.9 -38.51 91.25 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 110.021 -0.362 . . . . 74.219999999999999 110.021 176.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.71 -45.86 92.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.233 -0.439 . . . . 72.129999999999995 111.041 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.406 ' HG3' ' OD1' ' B' ' 280' ' ' ASN . 39.9 ttt180 -74.27 -18.69 60.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.383 -0.371 . . . . 74.319999999999993 110.923 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.496 ' HD2' HG22 ' B' ' 215' ' ' ILE . 14.2 t80 -90.57 -35.35 15.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.136 0.494 . . . . 75.25 110.346 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -74.85 -39.24 61.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.915 -0.584 . . . . 70.150000000000006 111.185 -175.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.482 ' HB2' ' HG2' ' B' ' 281' ' ' MET . . . -65.59 -18.21 65.15 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.035 0.445 . . . . 65.510000000000005 111.531 -178.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . 0.566 ' CH2' HG22 ' B' ' 229' ' ' THR . 16.7 t90 -63.67 -23.68 67.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.652 -0.703 . . . . 75.109999999999999 110.466 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.486 ' O ' HG21 ' A' ' 50' ' ' THR . 42.6 m-85 -93.61 9.71 35.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.219 -0.446 . . . . 74.140000000000001 111.075 178.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -76.74 -24.0 68.37 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.093 -1.051 . . . . 71.329999999999998 110.633 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.599 ' HA ' ' CE ' ' A' ' 58' ' ' MET . 14.8 m -72.38 -12.96 61.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.186 -0.507 . . . . 71.450000000000003 111.843 -177.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.486 HG21 ' O ' ' A' ' 47' ' ' PHE . 7.8 t -104.14 6.77 35.98 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.292 0.568 . . . . 75.099999999999994 110.612 -178.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.6 m -86.77 -24.78 24.96 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 112.935 0.717 . . . . 62.32 112.935 -175.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.507 ' HD1' ' H ' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -150.72 -172.31 4.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 122.095 -0.378 . . . . 63.049999999999997 111.22 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.507 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 9.6 pt-20 -110.85 -35.61 5.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.223 -0.444 . . . . 73.430000000000007 112.197 -173.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.3 p -115.15 155.56 26.9 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.094 -0.336 . . . . 71.010000000000005 110.094 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.612 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 21.9 ptmt -66.65 -37.93 85.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.738 0.304 . . . . 75.430000000000007 110.816 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -69.69 -27.67 65.21 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.07 -0.514 . . . . 73.120000000000005 111.32 -174.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.6 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.2 mt-30 -94.05 -32.47 13.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.448 -0.342 . . . . 74.549999999999997 110.652 178.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.728 ' HE2' HG12 ' B' ' 285' ' ' ILE . 16.6 ttp -72.57 -35.53 67.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.991 0.424 . . . . 74.010000000000005 110.497 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.559 ' HB2' HG21 ' B' ' 285' ' ' ILE . 35.2 tt0 -62.1 -37.55 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 75.140000000000001 110.654 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.69 -2.2 25.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.912 -0.585 . . . . 72.400000000000006 110.998 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 32.1 mmmt -110.81 0.39 17.26 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 116.32 -0.4 . . . . 74.230000000000004 110.953 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.748 ' HG3' ' H ' ' A' ' 63' ' ' GLN . 12.9 ptpt -54.97 -56.9 14.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.836 0.35 . . . . 73.099999999999994 110.367 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.748 ' H ' ' HG3' ' A' ' 62' ' ' LYS . 14.2 tp60 -74.49 -20.13 60.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.249 -0.432 . . . . 73.030000000000001 109.843 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -79.69 -36.26 37.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.754 -0.657 . . . . 74.340000000000003 111.434 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.482 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 20.8 ptp -79.27 -27.01 42.29 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.112 -1.069 . . . . 73.010000000000005 108.112 178.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.53 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 76.7 mtp -79.36 -17.46 54.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.864 -1.062 . . . . 74.439999999999998 110.477 175.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -58.56 -35.01 71.68 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.318 0.58 . . . . 53.219999999999999 110.819 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.733 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 14.8 p90 -108.92 -5.69 16.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.75 -0.659 . . . . 75.109999999999999 110.576 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.681 ' HD2' HD23 ' B' ' 277' ' ' LEU . 2.2 m-30 -60.52 -51.95 67.27 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 110.469 -0.197 . . . . 75.349999999999994 110.469 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 1.016 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.25 -43.36 70.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.629 0.728 . . . . 75.450000000000003 109.599 172.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.0 33.98 0.86 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.798 -1.092 . . . . 71.25 112.066 -171.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.733 ' HG3' ' O ' ' A' ' 68' ' ' TYR . 35.2 mtp180 -105.85 -43.2 4.94 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.626 -0.671 . . . . 71.140000000000001 110.958 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.806 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -91.57 6.93 43.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.817 -0.353 . . . . 74.239999999999995 111.127 -175.179 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.53 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 45.9 tttm -60.88 -53.16 60.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 74.200000000000003 110.461 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -57.52 -34.32 68.99 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.192 0.52 . . . . 73.420000000000002 110.882 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.8 mtt -68.28 -37.1 80.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 75.430000000000007 109.922 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.803 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 0.4 OUTLIER -73.0 -43.4 62.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.194 -0.912 . . . . 75.120000000000005 110.407 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -55.31 -39.02 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.449 0.643 . . . . 74.239999999999995 110.634 178.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.69 -22.49 53.88 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.121 -0.945 . . . . 75.409999999999997 112.269 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.478 ' OD1' ' HG3' ' B' ' 242' ' ' ARG . 20.2 m-80 -94.29 -8.67 38.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.446 -0.502 . . . . 74.219999999999999 111.854 -174.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.512 ' HE2' HD21 ' A' ' 77' ' ' LEU . 44.2 mtt -88.94 -175.24 4.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.216 0.532 . . . . 74.120000000000005 111.278 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.681 ' HA ' HD12 ' A' ' 85' ' ' ILE . 36.2 mt-10 69.8 -5.1 1.29 Allowed 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.668 -1.151 . . . . 62.020000000000003 113.207 177.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.02 -56.97 15.1 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.074 0.464 . . . . 74.329999999999998 110.703 178.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -73.78 -21.73 60.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 60.340000000000003 110.904 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.7 mt -67.52 -57.79 8.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.404 -0.362 . . . . 65.120000000000005 110.407 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.538 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 23.9 pt-20 -62.8 -26.43 68.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 72.140000000000001 111.292 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -98.49 1.45 46.67 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.996 0.369 . . . . 75.219999999999999 111.996 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -59.23 -40.57 86.29 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.981 -0.377 . . . . 71.230000000000004 109.981 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.62 -0.718 . . . . 74.340000000000003 109.962 174.875 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.562 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.0 p-10 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 110.111 -0.329 . . . . 62.409999999999997 110.111 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -85.69 -113.49 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.418 -0.356 . . . . 72.439999999999998 110.512 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -91.89 -13.7 30.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.857 0.837 . . . . 75.219999999999999 109.184 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -107.55 150.44 26.85 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.101 -0.954 . . . . 64.010000000000005 110.471 176.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.442 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.1 OUTLIER -76.14 50.93 0.64 Allowed 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.939 -1.028 . . . . 72.530000000000001 112.486 -177.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.461 ' CZ ' ' HB1' ' B' ' 206' ' ' ALA . 63.5 m-85 -53.87 -44.28 70.26 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.725 0.298 . . . . 73.519999999999996 111.536 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -72.08 -9.04 57.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.147 -0.479 . . . . 74.129999999999995 111.86 -175.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.442 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 74.1 mtt180 -99.08 -59.31 1.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.928 -0.397 . . . . 75.430000000000007 109.928 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.652 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.12 -23.72 22.41 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.868 0.692 . . . . 72.510000000000005 112.868 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 9.3 t -65.05 -25.43 67.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.499 0.185 . . . . 74.439999999999998 111.499 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.458 ' HB2' HD12 ' A' ' 17' ' ' LEU . 39.1 mt-10 -80.52 -26.39 38.13 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.359 0.6 . . . . 61.210000000000001 109.845 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.652 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.2 mm? -68.18 -47.77 67.07 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.061 -0.972 . . . . 75.230000000000004 109.341 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.496 HG22 ' HD2' ' A' ' 43' ' ' TYR . 82.1 mt -66.5 -33.01 60.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-N 115.839 -0.619 . . . . 71.010000000000005 110.415 175.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.461 ' HE2' ' HB3' ' B' ' 216' ' ' LYS . 5.0 tmmm? -57.84 -36.37 72.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.529 -0.76 . . . . 73.349999999999994 110.797 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.468 HD11 ' CB ' ' A' ' 13' ' ' GLU . 2.5 tm? -66.95 -41.68 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.668 -0.493 . . . . 74.25 109.668 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.39 -31.74 69.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 64.549999999999997 110.94 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -33.32 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.141 -0.481 . . . . 70.329999999999998 111.12 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.06 -24.75 47.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.126 -0.488 . . . . 72.209999999999994 111.764 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -91.01 -17.06 26.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.395 0.617 . . . . 74.319999999999993 110.114 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -85.92 8.79 18.98 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.259 -0.882 . . . . 74.129999999999995 110.257 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -84.18 10.05 11.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.947 -0.569 . . . . 71.540000000000006 111.217 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.407 HD21 ' CG ' ' B' ' 226' ' ' GLU . 0.8 OUTLIER -88.41 108.27 19.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.955 0.407 . . . . 73.209999999999994 110.763 177.83 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -74.39 -25.23 59.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.725 -0.671 . . . . 70.040000000000006 110.885 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . 0.407 ' CG ' HD21 ' B' ' 224' ' ' ASN . 11.1 pt-20 -82.2 -6.0 58.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.355 -0.384 . . . . 74.510000000000005 111.781 -176.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.785 HG22 ' H ' ' B' ' 228' ' ' GLN . 2.4 mt -124.12 179.7 2.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.84 -0.43 . . . . 74.129999999999995 109.84 -178.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.785 ' H ' HG22 ' B' ' 227' ' ' ILE . 2.3 mp0 -103.82 158.39 16.42 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.822 -0.436 . . . . 71.140000000000001 109.822 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 229' ' ' THR . . . . . 0.566 HG22 ' CH2' ' A' ' 46' ' ' TRP . 25.4 m -67.08 -16.44 64.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.212 0.53 . . . . 72.420000000000002 110.656 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -62.85 -33.36 86.78 Favored Glycine 0 CA--C 1.521 0.449 0 CA-C-N 115.603 -0.726 . . . . 75.109999999999999 113.733 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -72.45 -26.89 62.0 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 117.573 0.687 . . . . 74.519999999999996 110.6 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.7 t -72.06 -46.76 57.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.138 -0.483 . . . . 75.200000000000003 110.129 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 3.2 p -62.49 -34.52 77.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 73.209999999999994 110.366 176.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -69.81 -35.9 75.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.912 -0.585 . . . . 72.530000000000001 111.255 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 59.8 m -67.04 -35.38 79.74 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.09 0.471 . . . . 73.150000000000006 109.889 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.574 ' CD1' HD13 ' A' ' 14' ' ' LEU . 8.5 t80 -67.47 -38.71 84.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.734 -0.666 . . . . 64.340000000000003 109.69 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.806 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.6 ttm -65.97 -48.22 71.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.539 -0.755 . . . . 72.140000000000001 111.42 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.473 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 17.3 t-105 -61.15 -40.53 94.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 74.109999999999999 110.463 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.562 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.76 -42.16 99.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.882 -0.599 . . . . 74.239999999999995 110.997 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.716 HD23 ' SD ' ' A' ' 37' ' ' MET . 49.6 tp -60.75 -40.52 92.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 72.0 110.741 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.4 95.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.099 -0.501 . . . . 64.010000000000005 110.671 178.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . 0.478 ' HG3' ' OD1' ' A' ' 80' ' ' ASN . 64.3 ttt180 -67.08 -32.57 73.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.572 -0.74 . . . . 74.420000000000002 110.608 -179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.705 ' HD1' HG23 ' A' ' 15' ' ' ILE . 23.0 t80 -77.52 -40.06 44.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 72.099999999999994 110.992 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -73.2 -24.49 60.53 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.772 0.286 . . . . 74.420000000000002 111.772 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . 0.465 ' HB1' HD23 ' A' ' 77' ' ' LEU . . . -68.55 -19.77 64.51 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.247 0.546 . . . . 74.400000000000006 110.958 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.1 t90 -59.88 -33.46 71.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.241 -0.89 . . . . 64.239999999999995 111.054 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -72.84 -6.52 45.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.854 -0.612 . . . . 75.340000000000003 112.502 -171.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.481 ' O ' ' HE1' ' B' ' 258' ' ' MET . . . -59.8 -30.99 70.47 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.011 -1.09 . . . . 73.140000000000001 110.916 172.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 6.6 m -66.36 -16.29 63.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.724 0.41 . . . . 74.140000000000001 111.741 -177.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -116.43 17.33 15.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.067 0.46 . . . . 75.310000000000002 110.808 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 39.8 t -81.34 -56.55 3.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.031 -0.531 . . . . 72.239999999999995 110.655 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.579 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 5.2 m-85 -137.69 178.76 6.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.083 0.468 . . . . 74.340000000000003 112.188 -177.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -94.76 -33.75 12.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.36 -0.836 . . . . 75.209999999999994 110.985 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.417 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 75.4 p -114.21 154.34 28.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.242 -0.435 . . . . 72.349999999999994 110.211 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.489 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 21.3 ptmt -70.03 -29.8 66.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.816 0.341 . . . . 74.439999999999998 110.292 -178.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . 0.417 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.9 mp0 -55.17 -48.43 73.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.685 -0.689 . . . . 65.340000000000003 110.415 177.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.69 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.4 mt-30 -80.54 -41.82 23.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.73 -0.668 . . . . 75.420000000000002 109.986 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.489 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 23.1 ttt -55.18 -44.51 75.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.602 -0.726 . . . . 74.109999999999999 111.483 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.542 ' HA ' HD11 ' A' ' 85' ' ' ILE . 36.0 tt0 -64.75 -40.98 96.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.515 . . . . 73.140000000000001 111.432 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.74 -5.96 33.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 72.329999999999998 111.685 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 27.6 mmmt -106.75 4.73 27.98 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.247 -0.279 . . . . 72.450000000000003 110.247 -177.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.461 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.6 ptpt -51.38 -46.0 62.66 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.431 0.457 . . . . 74.5 110.788 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.461 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 11.3 tp60 -84.27 -18.03 37.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.766 0.317 . . . . 75.329999999999998 110.521 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . 0.447 ' CD ' ' HZ1' ' B' ' 261' ' ' LYS . 49.4 mt-10 -85.24 -30.56 23.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.525 . . . . 70.540000000000006 111.26 -177.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.476 ' HG3' ' HE1' ' A' ' 81' ' ' MET . 23.3 ptp -81.75 -29.0 33.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.342 -0.984 . . . . 74.019999999999996 108.342 175.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.803 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 71.9 mtp -87.87 11.23 16.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.864 -1.062 . . . . 75.439999999999998 110.462 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -75.0 -38.03 61.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 74.319999999999993 111.027 -177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.594 ' HA ' ' OD2' ' B' ' 271' ' ' ASP . 42.7 p90 -114.07 -4.21 13.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.884 -0.598 . . . . 71.340000000000003 110.818 -175.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -56.68 -52.46 64.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 121.02 -0.272 . . . . 73.420000000000002 110.607 -178.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 1.016 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.55 -50.85 52.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.619 0.574 . . . . 71.329999999999998 110.888 177.773 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' B' ' 268' ' ' TYR . 2.9 p30 -85.47 22.07 1.63 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.643 . . . . 74.129999999999995 112.647 -171.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.561 ' HB2' ' HE3' ' A' ' 37' ' ' MET . 33.3 mtp180 -82.03 -34.98 29.29 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.539 -0.464 . . . . 75.540000000000006 110.259 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.983 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.7 12.93 34.14 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.445 -0.502 . . . . 74.140000000000001 109.75 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.811 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 86.5 tttt -58.49 -54.87 42.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.726 -0.67 . . . . 74.150000000000006 110.261 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.38 -31.76 72.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.573 -0.739 . . . . 74.349999999999994 111.281 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 58.2 mtt -71.49 -36.28 71.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.927 -0.579 . . . . 71.209999999999994 110.389 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.681 HD23 ' HD2' ' A' ' 69' ' ' TYR . 38.0 tp -70.35 -41.21 73.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.292 -0.867 . . . . 74.209999999999994 110.127 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.476 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 11.1 t70 -60.9 -45.26 95.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.782 -0.644 . . . . 75.430000000000007 110.408 178.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -66.26 -17.08 64.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.239 -0.891 . . . . 71.140000000000001 112.235 -176.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . 0.406 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 36.4 m-80 -102.13 -2.08 30.14 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.879 -0.328 . . . . 73.299999999999997 111.392 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.482 ' HG2' ' HB2' ' A' ' 45' ' ' ALA . 46.2 mtt -91.54 -177.25 4.75 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.862 -0.335 . . . . 73.319999999999993 110.428 174.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.701 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 46.1 mt-10 67.38 -3.36 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.67 -0.696 . . . . 72.239999999999995 112.598 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.29 -58.75 5.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.07 0.462 . . . . 74.439999999999998 110.398 176.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -84.96 -3.13 58.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.778 -0.646 . . . . 74.420000000000002 110.996 177.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.728 HG12 ' HE2' ' A' ' 58' ' ' MET . 63.1 mt -85.01 -59.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.724 0.297 . . . . 73.120000000000005 110.437 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -67.11 -18.44 65.31 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.968 0.413 . . . . 73.329999999999998 110.561 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -107.01 6.92 29.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 111.011 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.612 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 60.7 t80 -59.19 -48.89 79.93 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.852 -0.425 . . . . 74.510000000000005 109.852 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 115.566 -0.743 . . . . 51.399999999999999 110.443 178.132 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.4 p-10 . . . . . 0 N--CA 1.451 -0.423 0 N-CA-C 108.422 -0.955 . . . . 61.149999999999999 108.422 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -84.14 -66.06 0.94 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.732 0.301 . . . . 71.209999999999994 111.416 -174.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -124.22 -41.44 2.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.457 -0.571 . . . . 74.239999999999995 109.457 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.76 157.25 31.79 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.551 -0.75 . . . . 74.540000000000006 110.635 177.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.482 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.31 43.41 0.72 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.092 -0.958 . . . . 64.120000000000005 112.468 -175.122 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -52.48 -51.42 59.44 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.885 0.374 . . . . 73.439999999999998 111.589 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.35 -5.57 24.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 74.319999999999993 111.759 -177.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.482 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 27.6 mmt180 -100.72 -58.88 1.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.313 -0.254 . . . . 75.530000000000001 110.313 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -52.19 -25.54 9.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.462 0.542 . . . . 63.240000000000002 112.462 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -62.89 -24.77 67.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.61 -0.268 . . . . 74.519999999999996 111.062 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.554 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.0 mt-10 -86.24 -28.96 23.5 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-O 121.108 0.48 . . . . 73.510000000000005 110.024 -178.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -64.26 -47.15 80.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.587 -0.733 . . . . 74.519999999999996 109.613 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.452 HG13 ' HB3' ' B' ' 239' ' ' ALA . 62.0 mt -69.51 -28.45 37.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.931 -0.577 . . . . 75.010000000000005 110.275 176.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 13' ' ' GLU . 2.7 mmmt -63.91 -28.69 70.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.543 . . . . 74.329999999999998 111.296 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.614 HD11 HD12 ' B' ' 214' ' ' LEU . 2.7 tm? -78.27 -31.13 48.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.259 -0.645 . . . . 74.120000000000005 109.259 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.75 -44.06 74.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.719 -0.673 . . . . 71.319999999999993 109.404 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.493 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 6.5 m-20 -58.21 -27.66 64.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.27 -0.877 . . . . 73.310000000000002 110.643 175.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -75.27 -32.39 61.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 75.239999999999995 110.813 -176.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -86.24 -20.4 28.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.426 0.632 . . . . 74.239999999999995 109.75 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.09 -10.05 59.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.142 -0.935 . . . . 73.409999999999997 109.574 176.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 80.3 mt-30 -77.48 -10.29 59.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.557 -0.747 . . . . 73.439999999999998 110.799 177.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.588 HD21 HG13 ' A' ' 27' ' ' ILE . 2.1 t30 -71.26 103.9 2.97 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.076 -0.713 . . . . 75.230000000000004 109.076 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -46.8 -44.73 19.45 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.528 0.936 . . . . 72.120000000000005 113.528 -173.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.57 -4.02 54.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.321 0.489 . . . . 74.540000000000006 112.321 -173.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.588 HG13 HD21 ' A' ' 24' ' ' ASN . 7.6 mt -104.0 151.4 6.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.649 -0.5 . . . . 71.140000000000001 109.649 177.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -98.97 160.15 14.46 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.177 -0.465 . . . . 74.049999999999997 110.382 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.08 -33.4 65.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.935 -0.575 . . . . 71.109999999999999 110.744 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.74 -33.65 83.55 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.484 -0.78 . . . . 75.019999999999996 113.828 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -74.63 -26.25 59.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.734 0.767 . . . . 74.099999999999994 110.365 -174.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -76.16 -32.84 23.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.671 -0.695 . . . . 75.040000000000006 110.305 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.564 ' O ' ' HG3' ' A' ' 37' ' ' MET . 92.1 p -72.4 -12.59 61.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.293 -0.412 . . . . 70.299999999999997 110.258 177.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -90.86 -39.72 12.16 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.121 -0.491 . . . . 73.230000000000004 110.798 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.447 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 5.6 p -67.41 -31.01 70.93 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.162 0.506 . . . . 74.340000000000003 110.276 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.642 ' HB3' HD11 ' B' ' 240' ' ' LEU . 2.6 t80 -68.52 -29.38 67.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 71.349999999999994 110.378 178.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.674 ' HG2' HD21 ' B' ' 240' ' ' LEU . 51.0 mtp -77.52 -45.69 24.71 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.719 -0.219 . . . . 75.340000000000003 110.635 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.0 t-105 -60.67 -38.92 86.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 74.439999999999998 110.138 176.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.47 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -64.49 -47.89 77.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.584 -0.735 . . . . 63.119999999999997 110.926 177.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.615 HD21 ' HG2' ' B' ' 237' ' ' MET . 51.2 tp -63.25 -40.5 97.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.714 0.292 . . . . 73.420000000000002 110.514 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.504 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -54.69 -46.68 74.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.765 -0.652 . . . . 51.119999999999997 111.496 -178.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -13.13 51.35 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.211 -0.595 . . . . 74.439999999999998 110.97 -177.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -80.94 -35.08 32.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.028 -0.73 . . . . 73.109999999999999 109.028 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -67.73 -35.13 78.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.888 -0.596 . . . . 73.010000000000005 109.535 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.541 ' HA ' ' CE ' ' B' ' 281' ' ' MET . . . -71.83 -17.81 62.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.656 -0.702 . . . . 72.109999999999999 111.529 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.2 t90 -63.4 -22.54 66.94 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.17 0.51 . . . . 75.109999999999999 110.224 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -89.32 -4.07 58.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 71.040000000000006 111.373 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.51 ' C ' ' HE3' ' A' ' 58' ' ' MET . . . -71.99 -37.69 60.27 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.603 -0.808 . . . . 34.439999999999998 112.124 -179.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 33.5 p -67.48 -23.18 65.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.895 0.379 . . . . 74.109999999999999 111.441 -176.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.9 t -100.19 11.28 39.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.15 0.5 . . . . 73.219999999999999 110.278 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 t -85.88 -29.53 23.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.422 -0.354 . . . . 62.009999999999998 110.685 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.83 ' HE2' ' HE3' ' A' ' 61' ' ' LYS . 0.3 OUTLIER -145.46 -175.21 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.208 0.447 . . . . 74.439999999999998 112.208 -179.721 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.534 ' HG3' HG22 ' A' ' 54' ' ' THR . 10.7 pt-20 -99.1 -32.28 11.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.418 -0.81 . . . . 73.310000000000002 112.162 -172.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.534 HG22 ' HG3' ' A' ' 53' ' ' GLU . 67.6 p -128.59 156.79 42.8 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 116.241 -0.436 . . . . 65.040000000000006 109.911 -178.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.607 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.6 ptmm? -69.05 -27.52 65.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.842 0.353 . . . . 74.420000000000002 110.641 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -63.45 -49.15 74.79 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.875 -0.602 . . . . 74.400000000000006 110.294 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.625 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -79.71 -36.97 36.69 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.813 -0.63 . . . . 75.310000000000002 110.31 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.563 ' HE1' HG12 ' B' ' 285' ' ' ILE . 14.3 ttt -60.2 -40.42 90.03 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.04 -0.527 . . . . 62.539999999999999 111.219 178.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.662 ' HA ' HD11 ' B' ' 285' ' ' ILE . 35.3 tt0 -63.7 -30.86 71.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.027 -0.533 . . . . 73.140000000000001 111.231 -177.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.67 -9.23 59.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.04 0.448 . . . . 63.439999999999998 111.042 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.83 ' HE3' ' HE2' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -105.0 -5.46 20.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.213 -0.449 . . . . 75.450000000000003 110.338 -176.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 63' ' ' GLN . 0.6 OUTLIER -51.86 -54.91 23.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 72.400000000000006 110.866 -177.603 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.5 ' N ' ' HD2' ' A' ' 62' ' ' LYS . 11.0 tp60 -75.31 -13.13 60.4 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.098 -0.501 . . . . 75.409999999999997 110.687 -175.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -87.55 -32.87 19.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.477 -0.328 . . . . 73.329999999999998 111.032 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.7 ptp -81.79 -26.73 34.17 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.497 -0.927 . . . . 64.030000000000001 108.497 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.652 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 71.6 mtp -83.3 -9.85 58.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.054 -0.975 . . . . 64.219999999999999 110.508 175.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 30.1 t70 -66.53 -18.13 65.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.996 -0.547 . . . . 73.120000000000005 111.153 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.494 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 26.6 p90 -124.63 -0.69 8.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.048 -0.524 . . . . 75.239999999999995 110.637 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.58 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 1.5 m-30 -66.79 -56.85 8.61 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 121.352 -0.139 . . . . 72.409999999999997 111.045 -178.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.925 ' HE1' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -46.55 -54.26 9.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.122 0.487 . . . . 74.230000000000004 110.363 174.812 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -81.6 17.42 1.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.803 -0.635 . . . . 63.509999999999998 111.771 -174.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -85.09 -50.2 7.63 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.028 0.442 . . . . 75.549999999999997 110.416 -177.485 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.572 ' HB3' ' HB3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -89.86 10.55 23.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.428 0.633 . . . . 75.230000000000004 109.646 -174.697 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.598 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 82.2 tttt -60.96 -49.73 76.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.069 -0.969 . . . . 74.230000000000004 110.735 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -58.95 -41.98 88.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 74.25 110.906 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 54.0 mtt -64.28 -36.45 84.13 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.653 -0.703 . . . . 73.430000000000007 110.354 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 2.3 tt -74.55 -44.88 48.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.326 -0.852 . . . . 75.299999999999997 110.353 -176.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.595 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 14.1 t70 -60.64 -38.74 85.8 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.327 0.584 . . . . 72.140000000000001 110.313 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.16 -24.64 66.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.196 -0.911 . . . . 74.239999999999995 111.668 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -99.4 -20.68 16.35 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.74 -0.384 . . . . 75.099999999999994 110.429 -178.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.524 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 16.5 mmt -61.67 -63.85 1.13 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.079 -0.51 . . . . 75.200000000000003 110.503 174.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.586 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 35.7 mt-10 -71.53 -7.34 47.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.074 -0.512 . . . . 75.239999999999995 111.479 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.89 -46.24 75.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.711 -0.477 . . . . 72.019999999999996 109.711 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -73.3 -35.64 66.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.05 -0.523 . . . . 74.430000000000007 110.268 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 86.5 mt -61.49 -54.27 37.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.853 -0.612 . . . . 75.25 111.655 -178.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.557 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.2 pt-20 -63.9 -19.56 65.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.822 0.344 . . . . 75.0 111.355 -177.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -104.95 6.87 33.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.466 -0.333 . . . . 74.239999999999995 111.093 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.461 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 84.3 t80 -60.97 -38.75 87.06 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.468 -0.567 . . . . 71.430000000000007 109.468 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.325 -0.852 . . . . 52.520000000000003 109.347 175.584 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.694 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 109.624 -0.51 . . . . 74.510000000000005 109.624 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . 0.922 ' HG2' ' HE2' ' B' ' 208' ' ' TYR . 1.6 pm0 -60.52 -88.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.139 0.422 . . . . 72.430000000000007 112.139 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -112.26 -40.37 4.18 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.437 -0.505 . . . . 75.319999999999993 110.957 -178.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -81.69 156.66 24.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.176 -0.465 . . . . 73.030000000000001 111.147 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.447 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -76.92 53.4 0.93 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.228 -0.896 . . . . 74.230000000000004 112.259 -178.949 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.922 ' HE2' ' HG2' ' B' ' 204' ' ' GLU . 63.3 m-85 -55.45 -44.25 76.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.71 0.291 . . . . 75.129999999999995 111.314 -178.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.54 -20.46 64.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.073 -0.512 . . . . 42.539999999999999 111.925 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -91.44 -62.58 1.4 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.104 -0.239 . . . . 74.439999999999998 110.686 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.695 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -53.74 -24.06 13.77 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.802 0.667 . . . . 73.439999999999998 112.802 -176.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 11.8 t -65.0 -28.09 69.27 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.672 0.272 . . . . 72.400000000000006 111.161 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.499 ' HB2' HD12 ' A' ' 17' ' ' LEU . 48.3 mt-10 -82.32 -25.23 34.1 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.331 0.586 . . . . 74.010000000000005 109.897 -176.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.695 HD22 ' HA ' ' B' ' 211' ' ' ALA . 3.3 mm? -67.04 -44.65 79.69 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.282 -0.872 . . . . 75.109999999999999 108.985 178.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.47 HG13 ' HB2' ' A' ' 39' ' ' ALA . 78.1 mt -73.07 -30.45 31.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.494 -0.775 . . . . 74.430000000000007 110.407 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 39.4 tptt -53.58 -45.53 70.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.765 -0.652 . . . . 75.409999999999997 111.344 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.2 tm? -64.31 -40.01 95.06 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.757 -0.461 . . . . 75.340000000000003 109.757 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -62.13 -27.01 68.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 75.439999999999998 110.973 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.481 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 94.7 m-20 -66.58 -31.68 72.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 63.240000000000002 110.65 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . 0.441 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -74.09 -32.24 63.15 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.746 0.308 . . . . 72.340000000000003 111.338 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -82.18 -15.82 51.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.148 0.499 . . . . 72.140000000000001 110.546 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -78.73 -16.08 57.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.839 -0.619 . . . . 65.109999999999999 109.712 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 59.6 mm-40 -85.5 -10.55 55.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.643 -0.708 . . . . 73.109999999999999 109.813 177.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.722 ' ND2' ' HG2' ' B' ' 226' ' ' GLU . 1.8 t30 -71.55 114.53 9.73 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.147 -0.933 . . . . 74.310000000000002 110.141 -175.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -58.96 -31.61 68.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.47 -0.786 . . . . 72.409999999999997 112.998 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . 0.722 ' HG2' ' ND2' ' B' ' 224' ' ' ASN . 12.0 pt-20 -82.69 -7.64 59.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.738 0.304 . . . . 74.049999999999997 111.383 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.57 ' CG2' ' HB2' ' B' ' 231' ' ' GLU . 4.5 mt -113.15 149.12 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.010000000000005 110.419 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -102.68 164.2 11.78 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.534 -0.543 . . . . 70.219999999999999 109.534 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 2.3 m -54.62 -38.51 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.965 0.412 . . . . 74.299999999999997 111.387 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -77.63 -8.74 87.16 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.121 -0.562 . . . . 64.099999999999994 113.663 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.57 ' HB2' ' CG2' ' B' ' 227' ' ' ILE . 5.8 mm-40 -88.72 -33.32 17.56 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.564 0.682 . . . . 72.109999999999999 109.539 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.2 t -71.81 -38.81 66.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.400000000000006 110.272 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 21.4 p -63.5 -43.05 98.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 64.510000000000005 110.4 178.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -70.99 -26.6 63.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.582 . . . . 70.010000000000005 110.866 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.426 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.5 t -66.55 -33.69 76.24 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.562 0.696 . . . . 75.140000000000001 109.158 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.595 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 5.7 t80 -73.38 -28.55 62.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.111 -0.949 . . . . 74.140000000000001 109.842 177.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.615 ' HG2' HD21 ' A' ' 40' ' ' LEU . 51.7 mtp -75.64 -46.19 32.96 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.368 -0.378 . . . . 74.129999999999995 110.611 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.41 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 27.2 t-105 -60.85 -40.35 92.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.089 0.471 . . . . 63.240000000000002 110.166 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.452 ' HB3' HG13 ' A' ' 15' ' ' ILE . . . -62.54 -45.56 92.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.609 -0.723 . . . . 72.239999999999995 110.81 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.674 HD21 ' HG2' ' A' ' 37' ' ' MET . 52.1 tp -67.82 -38.41 83.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.895 0.379 . . . . 74.439999999999998 110.511 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.559 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -56.87 -49.58 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.794 -0.639 . . . . 73.150000000000006 111.472 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -86.78 6.37 31.85 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.072 -0.651 . . . . 72.319999999999993 110.887 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -99.63 -36.66 9.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.838 -0.801 . . . . 71.129999999999995 108.838 172.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.35 -39.02 85.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.822 -0.626 . . . . 73.340000000000003 109.575 173.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . 0.524 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -67.21 -16.55 64.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.614 -0.721 . . . . 72.409999999999997 111.732 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -58.86 -34.97 72.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 74.439999999999998 110.858 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -76.53 -2.94 34.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 71.230000000000004 111.777 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -67.27 -30.08 75.07 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.55 -0.833 . . . . 61.200000000000003 111.26 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.0 p -63.89 -22.18 66.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.954 0.407 . . . . 73.140000000000001 111.262 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.9 t -111.91 18.27 18.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.325 -0.398 . . . . 73.519999999999996 110.73 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 9.7 t -81.32 -39.79 24.61 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.771 -0.455 . . . . 71.5 109.771 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.853 ' HE2' ' HE3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -149.17 -174.63 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 74.010000000000005 111.213 179.153 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' B' ' 254' ' ' THR . 12.9 pt-20 -90.34 -50.84 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.774 -0.648 . . . . 74.209999999999994 112.061 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.464 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 80.6 p -107.56 164.06 12.54 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 110.444 -0.206 . . . . 74.129999999999995 110.444 -176.393 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.522 ' HB2' HG22 ' A' ' 85' ' ' ILE . 22.6 ptmt -65.61 -33.48 76.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.766 0.317 . . . . 74.319999999999993 110.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.18 -45.8 83.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.99 -0.55 . . . . 75.230000000000004 111.072 -177.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -87.66 -7.11 57.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.134 -0.485 . . . . 72.129999999999995 111.21 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 9.9 ttt -93.29 -41.5 9.83 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.318 0.58 . . . . 75.209999999999994 109.959 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.556 ' HA ' HD11 ' A' ' 85' ' ' ILE . 44.4 tt0 -56.27 -42.48 77.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.199 -0.909 . . . . 74.439999999999998 111.171 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.29 -5.73 24.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.459 -0.791 . . . . 65.150000000000006 111.83 -176.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.853 ' HE3' ' HE2' ' B' ' 252' ' ' PHE . 0.1 OUTLIER -109.93 5.24 22.24 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.434 -0.348 . . . . 74.129999999999995 110.65 -175.696 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 13.5 ptpt -51.04 -47.59 61.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 71.430000000000007 111.399 -178.01 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.596 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 12.4 tp60 -78.89 -11.97 60.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.566 -0.288 . . . . 73.230000000000004 111.05 -173.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . 0.509 ' CD ' ' HZ1' ' B' ' 261' ' ' LYS . 36.7 mt-10 -83.89 -43.23 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.669 -0.241 . . . . 75.420000000000002 111.294 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.433 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.7 ptt? -76.81 -30.03 56.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.77 -0.772 . . . . 75.319999999999993 109.382 176.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.595 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 62.4 mtp -88.39 16.39 6.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.805 -0.634 . . . . 73.099999999999994 110.41 177.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 20.7 t70 -90.01 -36.49 14.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.136 0.493 . . . . 74.439999999999998 109.696 175.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -107.72 -14.53 14.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.983 -0.553 . . . . 72.329999999999998 111.544 -174.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.454 ' O ' ' HE3' ' A' ' 37' ' ' MET . 5.1 m-30 -57.17 -60.72 3.18 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 121.018 -0.273 . . . . 75.430000000000007 110.533 178.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.854 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.07 -45.39 52.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.645 0.736 . . . . 62.340000000000003 110.181 175.935 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -84.26 9.01 14.04 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.088 -0.96 . . . . 74.040000000000006 112.052 -170.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -88.39 -41.4 12.84 Favored 'General case' 0 CA--C 1.513 -0.453 0 O-C-N 121.834 -0.541 . . . . 73.209999999999994 110.648 -176.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.555 ' HB3' ' HB3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -94.79 7.48 45.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.509 0.671 . . . . 73.310000000000002 109.268 -175.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.925 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 79.5 tttt -61.54 -57.16 13.2 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.688 -1.142 . . . . 75.439999999999998 111.14 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.4 -32.6 74.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.703 0.287 . . . . 74.329999999999998 110.882 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 63.8 mtt -60.93 -41.12 95.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.481 0.658 . . . . 75.319999999999993 109.509 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.652 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 0.9 OUTLIER -69.49 -41.87 75.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.147 -0.933 . . . . 70.329999999999998 109.73 179.08 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.76 -41.45 86.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.543 -0.753 . . . . 72.200000000000003 110.611 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.9 -20.87 59.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.255 -0.884 . . . . 75.319999999999993 112.034 -177.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -92.25 -24.68 18.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.676 -0.41 . . . . 72.120000000000005 110.556 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.588 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 18.3 mmt -58.98 -59.3 5.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.916 -0.584 . . . . 74.310000000000002 110.69 174.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.592 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.9 mt-10 -63.57 -20.99 66.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.595 -0.73 . . . . 75.340000000000003 112.336 -174.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.92 -48.72 77.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.176 0.512 . . . . 71.299999999999997 110.139 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -77.07 -25.32 52.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.005 -0.543 . . . . 74.219999999999999 110.445 178.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.662 HD11 ' HA ' ' A' ' 59' ' ' GLN . 63.4 mt -71.03 -56.31 11.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.095 -0.502 . . . . 73.209999999999994 111.279 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -64.4 -28.21 69.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.739 0.304 . . . . 74.530000000000001 111.64 -176.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -91.71 3.21 55.63 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.99 -0.284 . . . . 72.25 111.087 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.607 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 80.4 t80 -59.14 -39.78 83.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.85 -0.159 . . . . 74.349999999999994 110.935 -179.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 . . . . . 0 C--N 1.326 -0.42 0 CA-C-O 121.079 0.466 . . . . 71.010000000000005 110.212 178.26 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.5 p-10 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.844 0.354 . . . . 74.209999999999994 110.178 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -79.5 -86.37 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.416 -0.587 . . . . 75.349999999999994 109.416 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -113.09 -42.71 3.49 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.765 -0.828 . . . . 71.420000000000002 108.765 170.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -71.81 154.12 41.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.271 -0.877 . . . . 75.040000000000006 111.972 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.486 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -77.77 57.07 1.6 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.239 -1.346 . . . . 74.310000000000002 111.954 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.412 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 67.3 m-85 -54.75 -40.91 69.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.315 -0.402 . . . . 73.319999999999993 111.802 -178.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.74 -16.18 61.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 72.200000000000003 111.655 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -87.33 -60.91 1.84 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.532 -0.304 . . . . 74.129999999999995 110.389 176.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.745 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -61.53 -16.74 50.5 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.887 0.699 . . . . 75.510000000000005 112.887 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.538 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 14.7 t -65.05 -30.44 71.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.035 -0.266 . . . . 64.540000000000006 111.016 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.498 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.2 mt-10 -81.6 -26.36 34.96 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.167 0.508 . . . . 74.430000000000007 110.151 -176.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.745 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.6 mm? -63.6 -41.67 98.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.543 -0.753 . . . . 75.329999999999998 109.804 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.491 HG23 ' HD2' ' B' ' 243' ' ' TYR . 69.1 mt -72.71 -22.74 20.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.609 -0.723 . . . . 72.409999999999997 110.688 178.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 12' ' ' THR . 30.7 mmmt -64.42 -34.57 78.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.564 -0.289 . . . . 74.109999999999999 111.024 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.473 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.4 tm? -63.13 -37.27 86.55 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.009 -0.737 . . . . 75.510000000000005 109.009 177.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.47 71.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.657 -0.701 . . . . 74.049999999999997 110.491 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.501 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 12.1 m-80 -59.96 -43.53 95.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.762 -0.654 . . . . 75.219999999999999 110.553 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -65.46 -35.23 80.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.769 -0.651 . . . . 75.200000000000003 111.436 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.37 -27.21 41.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 72.409999999999997 110.633 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.88 -0.91 36.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.316 0.579 . . . . 73.409999999999997 110.288 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 94.4 mt-30 -75.16 -8.85 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.034 -0.53 . . . . 72.319999999999993 109.982 174.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.548 HD21 ' HG2' ' A' ' 26' ' ' GLU . 1.4 m120 -78.93 156.14 28.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.323 -0.853 . . . . 75.540000000000006 110.1 175.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.2 t -128.46 -14.78 4.66 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.131 0.491 . . . . 75.450000000000003 109.922 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.548 ' HG2' HD21 ' A' ' 24' ' ' ASN . 1.6 pm0 -83.94 -2.73 57.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.563 -0.744 . . . . 75.230000000000004 110.303 174.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.2 mt -122.86 149.28 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 108.829 -0.804 . . . . 74.200000000000003 108.829 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.716 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -77.8 150.68 34.25 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.813 0.339 . . . . 73.239999999999995 110.391 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -61.3 -31.4 71.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.288 0.566 . . . . 72.109999999999999 109.771 174.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.704 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -68.08 -22.14 74.07 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.495 -0.775 . . . . 65.120000000000005 113.296 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.716 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 11.3 mm-40 -74.24 -34.25 63.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.334 0.588 . . . . 75.310000000000002 109.69 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.5 t -69.43 -44.61 79.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.592 -0.731 . . . . 73.120000000000005 110.534 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.412 ' HB3' ' CE1' ' B' ' 243' ' ' TYR . 15.1 p -65.29 -39.43 92.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.096 -0.502 . . . . 72.209999999999994 110.709 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.95 -35.01 79.79 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.847 -0.615 . . . . 64.329999999999998 110.383 177.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.531 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 52.5 m -63.83 -40.26 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.847 0.356 . . . . 73.409999999999997 110.096 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.708 ' HD1' HD13 ' B' ' 214' ' ' LEU . 10.4 t80 -62.06 -40.53 96.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.362 0.601 . . . . 73.239999999999995 109.737 177.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.65 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.4 ttm -67.14 -45.44 77.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.582 -0.736 . . . . 74.25 111.612 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.599 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 18.8 t-105 -64.61 -35.79 82.16 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.986 0.422 . . . . 72.030000000000001 110.568 177.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.455 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.74 -39.39 93.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.134 -0.485 . . . . 74.219999999999999 110.657 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.548 HD23 ' HE3' ' B' ' 237' ' ' MET . 56.4 tp -65.62 -35.6 81.3 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.466 -0.334 . . . . 73.450000000000003 110.161 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.456 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.3 -44.13 95.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 74.209999999999994 110.809 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.23 -35.68 66.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.175 -0.466 . . . . 73.310000000000002 110.627 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.455 ' HE1' ' HG ' ' B' ' 233' ' ' SER . 9.9 t80 -73.7 -33.51 64.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 64.420000000000002 110.786 -177.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.455 ' HB3' HD12 ' B' ' 277' ' ' LEU . 6.8 t-20 -76.09 -35.71 59.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.083 0.468 . . . . 64.150000000000006 110.767 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.73 -15.1 63.3 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.913 -0.585 . . . . 74.450000000000003 111.311 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -59.29 -35.82 74.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.714 -0.676 . . . . 74.540000000000006 111.428 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.512 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.3 m-85 -71.44 -9.08 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.402 -0.363 . . . . 71.109999999999999 111.888 -176.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.566 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -58.65 -29.56 64.31 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.349 -0.929 . . . . 70.439999999999998 111.294 175.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.2 p -61.44 -32.77 72.75 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.709 0.29 . . . . 73.530000000000001 111.652 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -103.1 16.86 25.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.185 0.517 . . . . 72.340000000000003 110.695 -176.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.29 -47.34 24.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.167 -0.469 . . . . 73.430000000000007 110.72 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.44 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.9 OUTLIER -142.68 -175.11 4.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.32 0.581 . . . . 71.25 112.297 -176.929 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -99.09 -28.06 13.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.916 -1.038 . . . . 65.349999999999994 111.679 -173.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.2 p -127.56 160.01 32.88 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.14 -0.482 . . . . 70.450000000000003 110.302 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.579 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 19.5 ptmt -68.92 -38.01 79.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.548 -0.296 . . . . 75.349999999999994 111.19 -177.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -30.2 71.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.502 -0.317 . . . . 74.420000000000002 111.415 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -92.29 -29.12 16.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.031 0.443 . . . . 63.009999999999998 110.557 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.566 ' HE2' ' O ' ' A' ' 48' ' ' GLY . 17.8 ttt -69.73 -43.8 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.724 -0.671 . . . . 75.200000000000003 110.778 178.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.627 ' HB2' HG23 ' B' ' 285' ' ' ILE . 36.1 tt0 -62.62 -33.47 75.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.699 -0.682 . . . . 72.439999999999998 111.639 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.02 -23.75 64.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.095 0.474 . . . . 74.310000000000002 111.133 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.44 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.3 mmmt -89.32 -0.36 57.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.917 -0.583 . . . . 74.5 110.777 -174.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.565 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 10.0 ptpp? -51.75 -47.16 64.2 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 123.597 0.561 . . . . 74.450000000000003 110.491 -175.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.565 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -86.15 -21.92 27.3 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.085 -0.507 . . . . 65.540000000000006 110.214 -175.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -73.41 -40.54 64.19 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.601 -0.727 . . . . 74.200000000000003 110.837 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.4 ptp -79.26 -27.58 42.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.257 0.551 . . . . 63.329999999999998 109.584 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.524 ' HE3' ' HB2' ' B' ' 278' ' ' ASP . 90.2 mtp -78.71 -17.33 56.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.813 -0.63 . . . . 75.209999999999994 110.915 177.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -60.63 -31.27 70.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.196 0.522 . . . . 64.439999999999998 111.345 -172.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -108.65 -10.43 15.2 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.598 -0.441 . . . . 72.140000000000001 111.005 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.523 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 5.4 m-30 -58.7 -53.94 52.74 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.623 0.249 . . . . 75.5 111.088 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.801 ' HE3' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -50.97 -53.63 31.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.254 0.55 . . . . 75.239999999999995 110.725 175.825 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.551 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 4.2 t70 -89.5 32.53 0.86 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.394 -0.821 . . . . 74.319999999999993 110.817 -172.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.641 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 2.1 mmm180 -94.01 -37.26 11.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.254 -0.43 . . . . 75.510000000000005 111.221 -177.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.694 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -100.19 10.77 40.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.479 -0.328 . . . . 71.310000000000002 110.464 -178.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 12.8 tttp -59.28 -59.72 5.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.589 . . . . 73.519999999999996 110.578 -176.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -63.35 -29.44 70.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.735 -0.666 . . . . 75.299999999999997 111.561 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.53 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 39.9 mtm -79.49 -27.77 41.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.226 0.536 . . . . 64.230000000000004 109.935 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.757 HD21 ' HD2' ' B' ' 269' ' ' TYR . 65.1 tp -70.11 -43.77 70.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.48 -0.782 . . . . 74.319999999999993 109.676 176.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.552 ' HB2' ' HE2' ' B' ' 266' ' ' MET . 6.2 t70 -59.02 -34.09 71.49 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.278 -0.874 . . . . 72.010000000000005 110.506 175.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.17 -12.49 60.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.41 -0.814 . . . . 71.430000000000007 112.125 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.442 ' OD1' ' HG2' ' B' ' 242' ' ' ARG . 31.4 m-80 -100.92 -20.41 15.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.988 0.423 . . . . 63.149999999999999 111.322 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.456 ' C ' ' H ' ' A' ' 83' ' ' ASP . 63.0 mtt -78.84 -168.07 1.32 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.363 -0.38 . . . . 75.239999999999995 110.019 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 6.4 mm-40 68.46 -32.31 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 113.741 1.015 . . . . 74.400000000000006 113.741 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.456 ' H ' ' C ' ' A' ' 81' ' ' MET . 27.8 t70 -53.25 -58.3 7.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.88 0.326 . . . . 74.329999999999998 111.88 -177.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.559 ' CE1' ' HE1' ' B' ' 258' ' ' MET . 51.0 p90 -88.53 -3.52 58.79 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.875 -0.73 . . . . 74.439999999999998 111.121 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.566 HG23 ' HB2' ' B' ' 259' ' ' GLN . 48.6 mt -74.78 -56.91 7.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.082 0.468 . . . . 72.319999999999993 109.84 173.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 10.0 pt-20 -60.86 -38.71 86.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 62.039999999999999 110.672 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -87.93 8.93 23.96 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.293 -0.412 . . . . 61.420000000000002 111.651 -177.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.426 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 72.8 t80 -57.72 -42.32 83.58 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.158 -0.312 . . . . 74.140000000000001 110.158 178.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 . . . . . 0 CA--C 1.519 -0.231 0 CA-C-O 121.156 0.503 . . . . 72.409999999999997 110.019 177.469 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.665 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.1 p-10 . . . . . 0 N--CA 1.454 -0.248 0 N-CA-C 109.653 -0.499 . . . . 75.319999999999993 109.653 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . 0.428 ' HB3' ' H ' ' B' ' 205' ' ' ASN . 7.9 tp10 -76.11 -83.43 0.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.11 -0.7 . . . . 74.230000000000004 109.11 177.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . 0.428 ' H ' ' HB3' ' B' ' 204' ' ' GLU . 50.3 t30 -119.57 -30.81 4.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.103 -0.702 . . . . 75.239999999999995 109.103 170.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -88.47 157.18 18.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.688 -0.687 . . . . 73.140000000000001 111.811 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.531 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -86.15 49.57 1.81 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.627 -1.17 . . . . 74.420000000000002 111.954 -175.571 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -45.13 -50.22 11.35 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.438 0.533 . . . . 75.430000000000007 112.438 -176.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -59.88 -44.09 94.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 75.340000000000003 112.229 -174.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.443 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 32.3 mmt180 -67.28 -49.99 62.1 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.148 0.425 . . . . 74.340000000000003 112.148 -175.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.604 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -63.3 -18.71 63.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.691 0.758 . . . . 72.310000000000002 110.62 -177.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 212' ' ' THR . . . . . 0.515 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 49.3 m -68.64 -28.12 66.61 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.006 -0.997 . . . . 75.030000000000001 111.014 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -80.06 -29.32 39.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.462 0.649 . . . . 74.030000000000001 109.509 -179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.708 HD13 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -63.94 -45.43 89.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.214 -0.903 . . . . 75.430000000000007 109.922 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.455 HG13 ' HB1' ' A' ' 39' ' ' ALA . 77.3 mt -66.8 -24.82 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 73.109999999999999 110.302 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -30.57 70.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 74.349999999999994 110.661 -176.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.612 HD13 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -70.37 -40.75 73.81 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.783 -0.821 . . . . 70.109999999999999 108.783 175.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.58 -29.88 70.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.474 -0.784 . . . . 75.450000000000003 110.183 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.506 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 2.7 t-20 -59.9 -38.34 81.99 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.33 -0.85 . . . . 71.239999999999995 110.405 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.41 -39.71 77.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.763 -0.653 . . . . 74.329999999999998 111.282 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -74.0 -25.24 59.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.159 0.504 . . . . 75.540000000000006 110.163 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -84.07 -3.64 58.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.837 -0.62 . . . . 63.399999999999999 110.751 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.506 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 98.5 mt-30 -71.03 -10.73 60.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.436 0.636 . . . . 70.010000000000005 109.94 173.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.497 HD21 ' HG2' ' B' ' 226' ' ' GLU . 0.7 OUTLIER -83.42 128.55 34.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.05 -0.977 . . . . 72.409999999999997 109.723 177.057 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -98.46 -21.82 16.36 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.079 0.466 . . . . 71.510000000000005 110.817 -175.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . 0.497 ' HG2' HD21 ' B' ' 224' ' ' ASN . 1.6 pm0 -76.9 -17.93 58.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.084 0.469 . . . . 70.209999999999994 110.724 176.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 7.3 mt -98.95 153.49 4.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.518 -0.919 . . . . 73.120000000000005 108.518 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.556 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 1.3 mp0 -80.57 146.38 31.28 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.454 -0.572 . . . . 74.200000000000003 109.454 176.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 27.6 m -58.25 -33.12 69.02 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.221 -0.659 . . . . 63.100000000000001 109.221 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . 0.512 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -61.71 -29.71 72.84 Favored Glycine 0 C--N 1.334 0.44 0 CA-C-N 115.084 -0.962 . . . . 24.420000000000002 113.149 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.556 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 11.4 mm-40 -66.2 -36.43 83.05 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 117.356 0.578 . . . . 73.150000000000006 109.657 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.1 t -77.78 -27.75 15.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.371 -0.831 . . . . 73.200000000000003 110.108 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 233' ' ' SER . . . . . 0.455 ' HG ' ' HE1' ' A' ' 43' ' ' TYR . 1.8 m -70.83 -40.92 72.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.797 -0.638 . . . . 65.450000000000003 109.46 176.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -71.44 -34.34 70.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.264 -0.88 . . . . 71.109999999999999 111.223 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.472 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 30.1 p -67.89 -36.41 80.18 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.949 0.404 . . . . 65.420000000000002 110.016 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.572 ' CD1' HD11 ' A' ' 14' ' ' LEU . 6.6 t80 -62.45 -42.04 99.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.522 0.677 . . . . 73.430000000000007 109.421 174.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.694 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 8.6 ttm -66.09 -45.83 79.82 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.518 -0.764 . . . . 74.140000000000001 111.733 179.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.53 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 33.9 t-105 -63.7 -35.45 80.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 72.420000000000002 110.716 177.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -66.17 -35.48 80.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.499 -0.319 . . . . 75.340000000000003 110.789 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.627 HD23 ' HE1' ' A' ' 37' ' ' MET . 52.4 tp -68.04 -35.87 78.97 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.285 -0.635 . . . . 75.239999999999995 109.285 176.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.433 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -66.15 -16.84 64.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.788 -0.642 . . . . 74.319999999999993 111.185 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . 0.442 ' HG2' ' OD1' ' A' ' 80' ' ' ASN . 36.8 mtm180 -95.47 -47.77 6.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.993 0.425 . . . . 75.129999999999995 110.411 176.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.491 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.6 t80 -70.99 -34.57 71.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.827 -0.624 . . . . 70.510000000000005 111.221 -173.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -81.33 -20.28 41.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.056 0.455 . . . . 62.340000000000003 111.229 -175.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -78.8 -7.46 57.87 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.469 . . . . 74.310000000000002 110.746 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -65.45 -27.64 68.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.487 -0.779 . . . . 73.450000000000003 110.908 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.704 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 74.2 m-85 -75.09 -0.52 19.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.08 -0.509 . . . . 72.120000000000005 112.037 -175.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.527 ' HA3' ' HE2' ' B' ' 258' ' ' MET . . . -63.2 -27.59 70.83 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.096 -1.05 . . . . 72.219999999999999 110.694 172.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 75.7 p -70.16 -8.63 51.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.456 -0.372 . . . . 72.340000000000003 111.672 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 10.8 t -120.87 8.29 10.5 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.967 -0.293 . . . . 73.430000000000007 110.873 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 68.6 m -78.0 -44.3 27.03 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-O 120.63 0.252 . . . . 74.25 110.641 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.488 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 2.4 m-85 -149.07 177.57 9.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.867 0.365 . . . . 75.329999999999998 111.231 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -91.5 -34.83 14.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.588 -0.733 . . . . 70.239999999999995 111.897 -172.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 75.4 p -117.98 161.4 19.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.411 -0.359 . . . . 74.439999999999998 110.508 -179.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.426 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.5 ptmt -66.55 -35.05 79.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.488 -0.324 . . . . 71.049999999999997 110.954 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.09 -50.03 73.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.061 0.458 . . . . 74.049999999999997 110.788 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.661 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 22.0 mt-30 -75.51 -23.62 56.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 75.140000000000001 110.392 -177.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.559 ' HE1' ' CE1' ' A' ' 84' ' ' TYR . 13.3 ttt -77.32 -47.52 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 74.150000000000006 110.665 177.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.566 ' HB2' HG23 ' A' ' 85' ' ' ILE . 33.6 tt0 -63.65 -35.07 79.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.693 -0.685 . . . . 63.130000000000003 111.689 -176.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.46 -13.31 62.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.844 0.354 . . . . 73.239999999999995 110.975 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.661 ' HD3' ' O ' ' B' ' 257' ' ' GLN . 3.2 mptp? -106.51 9.95 31.42 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.956 -0.566 . . . . 72.049999999999997 111.134 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.0 ptpt -50.37 -46.33 55.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 73.420000000000002 110.259 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.544 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.2 tp60 -80.54 -29.74 37.15 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.054 -0.521 . . . . 74.299999999999997 110.057 -177.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -67.26 -39.09 86.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 71.019999999999996 111.413 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -83.72 -24.29 31.27 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.563 -0.532 . . . . 70.049999999999997 109.563 -177.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.552 ' HE2' ' HB2' ' A' ' 78' ' ' ASP . 75.4 mtp -85.03 -22.37 29.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 75.109999999999999 111.599 179.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 17.0 t70 -62.21 -42.64 99.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.992 0.425 . . . . 72.409999999999997 111.025 -170.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.606 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 27.3 p90 -90.35 -14.42 33.12 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.907 -0.588 . . . . 72.019999999999996 110.647 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.757 ' HD2' HD21 ' A' ' 77' ' ' LEU . 1.3 m-30 -57.54 -47.12 82.89 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.606 0.241 . . . . 75.209999999999994 111.052 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.551 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -56.2 -48.13 77.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.195 0.521 . . . . 75.340000000000003 110.422 174.689 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -84.4 20.8 1.58 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.491 -0.777 . . . . 65.340000000000003 111.65 -171.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 14.6 mmm180 -90.38 -51.09 5.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 72.340000000000003 110.813 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.686 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -92.65 8.83 37.43 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.069 -0.514 . . . . 75.019999999999996 110.538 -177.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.801 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 87.8 tttt -59.59 -59.48 5.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.919 -0.582 . . . . 73.400000000000006 110.916 -177.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.33 -33.98 77.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.23 -0.441 . . . . 73.040000000000006 111.187 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 276' ' ' MET . . . . . 0.599 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 41.0 mtm -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.108 0.48 . . . . 75.519999999999996 110.441 -178.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.478 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 5.5 tt -70.96 -43.42 68.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.998 -0.742 . . . . 74.040000000000006 108.998 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.524 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 6.1 t70 -56.38 -37.13 69.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.961 -1.018 . . . . 72.209999999999994 111.12 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -68.47 -14.98 63.38 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.447 -0.797 . . . . 75.040000000000006 112.36 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -96.6 -13.33 22.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.878 0.371 . . . . 74.439999999999998 111.487 -178.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.432 ' C ' ' H ' ' B' ' 283' ' ' ASP . 62.9 mtt -85.56 179.58 7.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.777 0.323 . . . . 72.120000000000005 111.122 176.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.53 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 20.6 mt-10 69.89 -24.06 0.15 Allowed 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.416 1.086 . . . . 71.049999999999997 113.381 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' B' ' 281' ' ' MET . 30.1 t70 -50.25 -60.18 3.23 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.896 0.379 . . . . 73.430000000000007 111.699 -179.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -85.13 5.66 28.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 71.120000000000005 111.221 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.627 HG23 ' HB2' ' A' ' 59' ' ' GLN . 50.3 mt -92.82 -54.73 6.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.876 0.37 . . . . 74.329999999999998 110.507 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.8 pt-20 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.053 -0.521 . . . . 75.409999999999997 110.337 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.38 2.28 52.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 75.430000000000007 111.359 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.579 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 71.0 t80 -55.99 -48.19 76.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.634 0.254 . . . . 74.230000000000004 110.915 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.712 -178.462 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 108.944 -0.761 . . . . 63.200000000000003 108.944 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.98 -79.69 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.123 0.487 . . . . 64.510000000000005 110.759 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -125.71 -35.85 2.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.947 -0.569 . . . . 74.209999999999994 110.393 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.81 159.82 25.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.091 -0.504 . . . . 74.349999999999994 111.005 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.565 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -82.06 49.17 1.34 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.293 -0.867 . . . . 73.030000000000001 111.995 -176.413 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -51.93 -42.21 62.63 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.046 0.451 . . . . 74.209999999999994 111.235 -178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.11 -13.64 61.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.742 -0.663 . . . . 75.340000000000003 112.509 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 10' ' ' ARG . 20.5 mtm180 -94.71 -57.23 2.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.542 -0.463 . . . . 75.349999999999994 110.262 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.723 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -57.49 -22.47 44.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 64.349999999999994 112.54 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -62.75 -26.92 68.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.745 0.307 . . . . 72.219999999999999 110.955 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.451 ' HB2' HD11 ' B' ' 217' ' ' LEU . 30.0 mt-10 -83.12 -29.56 28.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.169 0.509 . . . . 73.310000000000002 109.772 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.723 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -62.82 -48.58 78.48 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.244 -0.889 . . . . 74.540000000000006 109.42 177.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.483 HG13 ' HB1' ' B' ' 239' ' ' ALA . 78.5 mt -64.07 -33.63 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.661 . . . . 74.129999999999995 110.281 176.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.415 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.6 tmmt? -60.11 -35.13 74.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.608 -0.724 . . . . 75.5 111.48 -176.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.428 HD11 HD13 ' B' ' 214' ' ' LEU . 2.6 tm? -63.54 -45.97 88.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.392 -0.596 . . . . 51.409999999999997 109.392 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.59 68.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.723 -0.671 . . . . 70.120000000000005 111.225 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.45 -26.33 68.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 74.099999999999994 111.214 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.575 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 2.9 mp0 -81.07 -14.97 57.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.838 0.351 . . . . 75.349999999999994 111.057 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -101.44 -35.28 9.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.95 0.405 . . . . 71.299999999999997 110.764 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.636 ' HA ' HG22 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -78.0 -8.95 58.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.208 -0.451 . . . . 73.310000000000002 110.721 -175.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.575 ' NE2' ' HA ' ' A' ' 20' ' ' GLN . 8.7 pt20 -80.87 9.0 7.0 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.839 -0.344 . . . . 74.209999999999994 111.531 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.592 HD21 HG13 ' A' ' 27' ' ' ILE . 1.8 t30 -82.84 103.46 12.34 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.231 -1.026 . . . . 74.510000000000005 108.231 173.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -60.16 -31.68 70.33 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 113.146 0.795 . . . . 74.010000000000005 113.146 -169.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -80.68 -13.43 59.03 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.227 0.455 . . . . 75.239999999999995 112.227 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.592 HG13 HD21 ' A' ' 24' ' ' ASN . 9.2 mt -98.66 147.8 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.448 -0.575 . . . . 51.119999999999997 109.448 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -89.42 159.75 17.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.824 0.345 . . . . 73.230000000000004 110.301 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.3 m -56.88 -33.33 66.77 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.529 -0.759 . . . . 75.510000000000005 111.315 -176.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -58.27 -32.4 67.75 Favored Glycine 0 C--N 1.332 0.34 0 CA-C-N 115.62 -0.718 . . . . 54.310000000000002 113.871 -176.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -69.27 -31.79 70.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.27 0.535 . . . . 74.310000000000002 110.932 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.636 HG22 ' HA ' ' A' ' 22' ' ' ASN . 39.3 t -88.63 -40.82 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.855 -0.611 . . . . 74.310000000000002 110.967 -176.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.8 p -61.59 -41.78 97.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.953 0.406 . . . . 72.329999999999998 110.635 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.3 73.88 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.014 -0.539 . . . . 74.329999999999998 110.958 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.474 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 46.2 m -63.51 -36.21 83.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.886 0.374 . . . . 63.43 110.068 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.552 ' CD1' HD11 ' B' ' 214' ' ' LEU . 2.5 t80 -69.5 -32.78 71.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.374 0.606 . . . . 73.439999999999998 109.66 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.776 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.2 tpt -67.36 -52.33 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.45 -0.795 . . . . 73.400000000000006 110.945 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.647 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -63.84 -34.89 78.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.937 -0.574 . . . . 75.450000000000003 110.906 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.41 -40.64 97.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.122 -0.49 . . . . 75.510000000000005 111.095 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.413 HD23 ' HE3' ' B' ' 237' ' ' MET . 53.9 tp -68.37 -35.29 77.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.734 -0.469 . . . . 64.25 109.734 178.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.88 77.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.400000000000006 111.0 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.439 ' HG2' ' CG ' ' B' ' 280' ' ' ASN . 10.8 mtp180 -77.48 -46.46 22.42 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.019 -0.272 . . . . 74.239999999999995 111.139 177.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.566 ' HD2' HG22 ' B' ' 215' ' ' ILE . 7.5 t80 -66.57 -31.86 72.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 62.409999999999997 110.884 -175.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -77.33 -38.3 50.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.038 0.447 . . . . 62.409999999999997 109.95 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.88 -19.61 65.04 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.792 -0.64 . . . . 71.230000000000004 111.171 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.5 t90 -59.39 -33.54 71.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.845 -0.616 . . . . 74.409999999999997 110.029 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -82.66 -5.47 58.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 75.129999999999995 111.131 178.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.545 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -70.62 -23.87 77.36 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.896 -0.881 . . . . 73.349999999999994 110.896 174.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -61.46 -31.84 71.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.949 0.405 . . . . 71.109999999999999 111.26 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -97.91 13.42 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 74.439999999999998 111.103 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.1 m -77.02 -34.59 57.38 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 111.854 0.316 . . . . 71.340000000000003 111.854 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.704 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -143.33 -172.27 3.66 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.641 -0.424 . . . . 75.150000000000006 111.63 -179.551 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.704 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 16.9 pt-20 -108.31 -30.11 8.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.376 -0.829 . . . . 72.099999999999994 112.025 -170.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.443 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 47.1 p -127.87 155.28 44.4 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 109.715 -0.476 . . . . 70.329999999999998 109.715 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -72.03 -29.57 64.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.84 -0.344 . . . . 74.25 110.77 -177.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.443 ' OE1' ' HB ' ' A' ' 54' ' ' THR . 2.0 mp0 -60.92 -46.19 91.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.231 0.538 . . . . 74.140000000000001 110.186 177.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.678 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 24.6 mt-30 -81.58 -37.57 27.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.667 -0.697 . . . . 74.230000000000004 110.581 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.545 ' HE2' ' O ' ' A' ' 48' ' ' GLY . 16.5 ttt -63.17 -42.73 99.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 71.219999999999999 111.211 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 34.9 tt0 -64.69 -32.18 73.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.277 -0.419 . . . . 72.239999999999995 110.583 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.57 -12.34 60.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.149 0.5 . . . . 75.519999999999996 110.854 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.678 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -106.53 11.1 31.0 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.208 -0.451 . . . . 74.030000000000001 109.979 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.611 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 15.4 ptpt -54.27 -49.37 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 71.540000000000006 110.064 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.611 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.4 tp60 -75.15 -26.97 59.55 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.98 -0.555 . . . . 74.439999999999998 110.239 -176.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.532 ' HG2' ' HA ' ' A' ' 61' ' ' LYS . 25.0 mm-40 -58.85 -49.47 77.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.99 -0.55 . . . . 74.230000000000004 111.011 -178.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -82.69 -34.86 27.2 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.067 0.46 . . . . 74.510000000000005 110.631 -177.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.659 ' HE2' ' HB3' ' B' ' 277' ' ' LEU . 67.1 mtp -77.08 -21.98 53.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 74.299999999999997 112.097 -174.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.446 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 25.6 t70 -58.95 -36.25 74.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 73.230000000000004 111.365 -171.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.477 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 28.2 p90 -107.15 -6.11 17.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 72.510000000000005 111.534 -176.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.518 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 3.4 m-30 -58.56 -41.95 86.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.709 0.29 . . . . 73.349999999999994 110.943 -178.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.49 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -53.28 -52.35 59.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 71.510000000000005 110.665 174.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -90.48 65.98 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 75.200000000000003 110.958 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 15.3 mmm-85 -130.98 -23.24 2.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.195 -0.457 . . . . 71.140000000000001 111.337 177.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.746 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -116.05 7.74 14.35 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.543 -0.463 . . . . 74.519999999999996 111.755 -178.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.422 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 6.3 pttm -76.2 -33.92 59.29 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.856 -0.738 . . . . 74.120000000000005 110.323 -173.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 1.6 pm0 -67.69 -25.17 65.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.278 0.561 . . . . 74.109999999999999 110.604 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.495 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 58.5 mtm -91.16 -18.95 23.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.818 -0.628 . . . . 71.219999999999999 109.971 178.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.484 HD11 ' HB3' ' B' ' 244' ' ' ASN . 7.0 tt -82.39 -37.39 25.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.73 -0.668 . . . . 74.140000000000001 109.729 176.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.487 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 12.8 t70 -57.81 -37.56 73.99 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.256 0.551 . . . . 70.040000000000006 110.142 177.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.1 70.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.265 -0.879 . . . . 73.129999999999995 111.679 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -82.83 -23.09 33.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.016 0.436 . . . . 75.010000000000005 110.286 -178.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.48 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.3 mmt -66.54 -50.28 63.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.81 -0.632 . . . . 72.340000000000003 110.123 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.491 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 44.7 mt-10 -55.77 -31.82 62.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.681 -0.69 . . . . 73.299999999999997 111.637 -177.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -53.7 -34.74 59.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.855 0.36 . . . . 74.439999999999998 111.04 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.72 -29.14 10.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.286 -0.415 . . . . 74.510000000000005 111.255 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 81' ' ' MET . 58.5 mt -66.77 -64.53 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.653 0.242 . . . . 65.239999999999995 111.653 -178.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.3 pt-20 -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.451 -0.5 . . . . 75.0 110.745 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -93.04 15.72 14.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.139 -0.482 . . . . 73.450000000000003 111.004 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.569 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 24.7 t80 -54.46 -49.78 69.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.707 0.289 . . . . 74.010000000000005 110.985 178.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 111.004 179.148 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.665 0.269 . . . . 75.120000000000005 110.562 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -82.76 -94.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 75.450000000000003 111.164 -177.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -103.32 -26.66 12.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.879 -0.6 . . . . 61.409999999999997 110.055 -177.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.561 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -110.0 153.29 24.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.581 -0.736 . . . . 64.439999999999998 110.475 176.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.647 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -79.05 54.89 1.69 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.422 -0.808 . . . . 71.510000000000005 112.464 -177.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.422 ' CE1' ' HB3' ' B' ' 206' ' ' ALA . 17.6 m-85 -50.95 -40.8 58.4 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.92 0.39 . . . . 75.219999999999999 111.379 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.34 -27.53 66.0 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.479 -0.782 . . . . 71.519999999999996 112.696 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 53.6 mtm-85 -91.88 -55.38 3.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.548 -0.461 . . . . 73.349999999999994 110.651 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.589 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -57.4 -22.64 44.31 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 73.25 112.814 -177.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 7.0 t -67.04 -25.81 66.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.95 0.405 . . . . 64.140000000000001 110.51 -177.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -82.45 -29.22 30.79 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.345 0.593 . . . . 73.439999999999998 109.787 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -64.51 -45.35 87.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.076 -0.965 . . . . 74.530000000000001 109.392 177.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.566 HG22 ' HD2' ' A' ' 43' ' ' TYR . 82.0 mt -67.35 -33.03 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.564 -0.744 . . . . 73.530000000000001 110.452 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -35.59 73.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.683 -0.69 . . . . 73.129999999999995 111.286 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.523 HD13 HD12 ' A' ' 14' ' ' LEU . 3.1 tm? -64.57 -45.37 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.414 -0.587 . . . . 75.329999999999998 109.414 178.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.88 -31.84 68.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 74.349999999999994 111.164 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.483 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -61.08 -38.08 84.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 73.239999999999995 110.919 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -67.68 -34.48 76.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.197 -0.456 . . . . 71.349999999999994 111.466 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -79.33 -23.07 43.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.445 0.64 . . . . 73.510000000000005 110.049 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -75.64 -16.25 60.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.266 -0.879 . . . . 74.209999999999994 110.267 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 35.7 mt-30 -76.63 -4.11 41.29 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 74.409999999999997 111.201 -179.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.538 HD21 HG13 ' B' ' 227' ' ' ILE . 1.5 t30 -73.01 107.66 5.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.545 -0.539 . . . . 52.130000000000003 109.545 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.0 t -57.71 -35.71 71.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.017 0.747 . . . . 75.209999999999994 113.017 -171.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -85.32 1.55 47.93 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.508 0.559 . . . . 73.319999999999993 112.508 -177.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.538 HG13 HD21 ' B' ' 224' ' ' ASN . 5.1 mt -113.76 149.85 16.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.03 0.443 . . . . 61.310000000000002 110.326 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -92.53 160.22 15.14 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.853 -0.612 . . . . 65.519999999999996 109.875 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 6.8 m -63.02 -29.63 70.97 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.19 -0.459 . . . . 75.530000000000001 111.227 -176.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -67.38 -12.22 60.71 Favored Glycine 0 C--N 1.331 0.297 0 CA-C-N 115.901 -0.59 . . . . 73.420000000000002 113.339 -177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.404 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 67.9 mm-40 -83.47 -25.79 30.84 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.342 -0.505 . . . . 74.409999999999997 110.524 178.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.9 t -85.35 -39.16 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.963 -0.562 . . . . 73.340000000000003 110.43 -177.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.2 p -59.06 -41.64 88.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 74.299999999999997 110.957 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.83 -32.1 71.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 74.439999999999998 111.016 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 49.9 m -65.43 -38.02 88.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.82 0.343 . . . . 62.399999999999999 110.279 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.662 ' HD1' HD13 ' A' ' 14' ' ' LEU . 11.9 t80 -66.36 -33.66 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.259 0.552 . . . . 65.329999999999998 109.831 178.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.746 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 9.3 ttm -69.18 -46.0 68.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.507 -0.769 . . . . 74.540000000000006 111.735 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.565 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 19.8 t-105 -64.59 -38.51 91.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.85 0.357 . . . . 74.010000000000005 110.645 177.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.493 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -61.82 -40.29 94.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.051 -0.522 . . . . 71.129999999999995 110.667 178.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.776 HD21 ' SD ' ' A' ' 37' ' ' MET . 45.3 tp -67.84 -32.6 73.24 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.257 -0.429 . . . . 72.010000000000005 110.831 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.42 -37.35 85.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.010000000000005 110.893 178.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -80.77 -30.69 36.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 75.299999999999997 110.888 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.48 ' HD2' HG23 ' A' ' 15' ' ' ILE . 6.6 t80 -82.07 -33.07 30.03 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.082 -0.508 . . . . 72.219999999999999 110.999 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . 0.484 ' HB3' HD11 ' A' ' 77' ' ' LEU . 9.9 t-20 -78.28 -38.71 41.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.416 -0.356 . . . . 72.420000000000002 111.177 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -63.8 -13.38 43.79 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.073 0.463 . . . . 73.420000000000002 111.482 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -54.02 -36.37 62.93 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.511 -0.768 . . . . 71.140000000000001 110.258 175.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -78.36 -5.55 52.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 74.099999999999994 111.958 -177.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.507 ' O ' ' HE1' ' B' ' 258' ' ' MET . . . -65.67 -29.82 75.97 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.402 -0.904 . . . . 64.409999999999997 111.578 176.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.5 p -65.07 -34.95 79.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.995 0.426 . . . . 74.209999999999994 111.298 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.2 t -92.35 7.74 41.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.419 -0.355 . . . . 71.310000000000002 111.298 -176.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 71.2 m -74.41 -40.16 62.18 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 116.737 -0.211 . . . . 63.009999999999998 111.386 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.528 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -151.41 -179.31 7.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.19 0.519 . . . . 74.010000000000005 111.731 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -94.42 -45.43 7.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.216 -0.902 . . . . 74.239999999999995 111.704 -173.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 41.2 p -106.1 157.87 17.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.369 -0.378 . . . . 70.129999999999995 110.227 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.569 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 11.2 ptmm? -66.84 -33.28 75.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.88 0.372 . . . . 74.439999999999998 110.237 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.11 -50.39 73.42 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.61 -0.723 . . . . 74.230000000000004 110.738 -179.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.572 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 24.2 mt-30 -78.66 -31.88 46.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.981 -0.554 . . . . 62.329999999999998 110.845 -177.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.507 ' HE1' ' O ' ' B' ' 248' ' ' GLY . 13.7 ttt -64.96 -43.77 91.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.133 0.492 . . . . 75.530000000000001 110.194 176.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -63.09 -35.32 79.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.532 -0.758 . . . . 75.319999999999993 110.859 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.3 -11.5 60.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.222 -0.445 . . . . 60.149999999999999 111.197 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -113.44 -1.19 14.24 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.499 -0.319 . . . . 73.430000000000007 110.51 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.685 ' HA ' ' HE1' ' B' ' 265' ' ' MET . 29.1 ttpp -55.4 -54.79 39.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.486 -0.324 . . . . 65.129999999999995 111.206 -176.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -68.41 -26.72 65.68 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.973 -0.291 . . . . 73.530000000000001 110.74 -178.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -73.54 -37.88 65.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.524 -0.307 . . . . 72.420000000000002 111.285 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.685 ' HE1' ' HA ' ' B' ' 262' ' ' LYS . 17.9 ptp -79.85 -30.21 40.26 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.297 -1.001 . . . . 74.409999999999997 108.297 177.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.487 ' HE3' ' HB2' ' A' ' 78' ' ' ASP . 58.5 mtp -90.5 29.77 1.24 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.981 -1.008 . . . . 74.120000000000005 110.638 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -111.03 -32.91 6.64 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.958 -1.126 . . . . 75.140000000000001 107.958 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -87.16 -33.72 19.3 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.576 -1.193 . . . . 74.329999999999998 112.617 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -52.53 -52.52 54.39 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.987 -0.745 . . . . 74.450000000000003 108.987 177.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.49 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -65.45 -60.72 2.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.225 0.536 . . . . 71.329999999999998 110.829 174.263 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -88.82 62.96 6.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.811 -0.631 . . . . 72.329999999999998 112.04 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -147.76 -29.07 0.33 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 72.420000000000002 111.695 171.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.555 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -84.41 0.9 47.71 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.801 -0.814 . . . . 75.349999999999994 108.801 174.886 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.486 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 86.9 tttt -64.32 -53.87 42.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.414 -1.266 . . . . 74.25 110.676 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.25 -30.84 69.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.43 . . . . 73.510000000000005 111.818 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 276' ' ' MET . . . . . 0.486 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 60.1 mtm -84.87 -26.66 27.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.84 0.352 . . . . 74.409999999999997 110.602 -179.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.659 ' HB3' ' HE2' ' A' ' 66' ' ' MET . 3.7 tt -67.02 -33.92 76.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.016 -0.538 . . . . 74.450000000000003 109.784 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -61.29 -44.18 97.65 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.837 -0.62 . . . . 72.140000000000001 110.831 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.34 65.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.391 -0.822 . . . . 65.230000000000004 111.159 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . 0.439 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 86.1 m-20 -88.65 -15.91 33.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.046 -0.525 . . . . 74.019999999999996 110.344 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.412 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -75.5 -39.47 58.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 72.340000000000003 109.844 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.653 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 42.7 mt-10 -51.22 -39.59 56.9 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.374 -0.83 . . . . 73.400000000000006 111.934 -176.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -44.7 -47.81 10.66 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.939 0.774 . . . . 74.319999999999993 111.855 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -90.41 -29.86 17.75 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.249 -0.432 . . . . 73.239999999999995 111.017 -177.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.412 HG13 ' O ' ' B' ' 281' ' ' MET . 72.4 mt -64.37 -55.53 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 73.340000000000003 110.992 179.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.653 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -68.75 -17.63 64.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.283 -0.417 . . . . 72.239999999999995 111.664 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -107.95 9.46 28.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.921 0.341 . . . . 73.019999999999996 111.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -55.68 -45.73 77.73 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.792 0.329 . . . . 74.230000000000004 110.572 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 . . . . . 0 C--N 1.327 -0.411 0 CA-C-N 115.848 -0.615 . . . . 71.409999999999997 110.978 178.323 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.585 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 1.7 p-10 . . . . . 0 N--CA 1.453 -0.288 0 N-CA-C 109.665 -0.495 . . . . 75.239999999999995 109.665 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.91 -89.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 63.539999999999999 110.642 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -111.3 -22.34 11.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.833 -0.621 . . . . 72.439999999999998 110.183 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.69 160.96 17.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 75.329999999999998 111.192 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.462 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -85.41 49.98 1.86 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.236 -0.893 . . . . 65.120000000000005 111.769 -177.668 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.585 ' HD2' ' HB2' ' A' ' 3' ' ' ASN . 89.5 m-85 -52.19 -46.3 65.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.037 0.446 . . . . 74.349999999999994 111.321 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.53 -6.53 47.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 60.310000000000002 112.02 -174.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.552 ' HA ' ' NE ' ' A' ' 10' ' ' ARG . 4.1 mmp_? -96.37 -58.45 2.06 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 121.089 -0.244 . . . . 71.310000000000002 110.561 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.678 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -56.42 -20.35 19.29 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.626 0.602 . . . . 73.099999999999994 112.626 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.3 t -69.35 -23.34 63.75 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 121.03 -0.268 . . . . 71.439999999999998 111.334 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.52 ' HB2' HD11 ' B' ' 217' ' ' LEU . 59.9 mt-10 -80.66 -28.63 36.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.271 -0.641 . . . . 73.340000000000003 109.271 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.678 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -64.41 -43.19 95.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.246 -0.888 . . . . 75.340000000000003 109.6 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 78.2 mt -69.46 -25.17 28.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.547 -0.751 . . . . 74.030000000000001 110.55 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.492 ' HD2' ' HA ' ' A' ' 16' ' ' LYS . 22.2 mmmt -61.75 -38.51 88.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.374 -0.375 . . . . 75.120000000000005 111.872 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.493 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.1 tm? -65.4 -34.23 77.81 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.235 -0.654 . . . . 75.519999999999996 109.235 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.98 -35.94 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.584 -0.735 . . . . 74.329999999999998 110.393 -177.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -69.92 -12.3 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.969 -0.56 . . . . 75.129999999999995 111.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.29 -39.65 17.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.792 0.329 . . . . 74.25 110.692 175.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -76.35 -22.48 54.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.293 0.568 . . . . 64.109999999999999 110.259 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.409 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 4.3 t-20 -73.23 -11.82 60.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 74.230000000000004 110.553 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -82.22 0.83 39.39 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 116.096 -0.502 . . . . 73.5 111.674 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.615 HD21 HG13 ' A' ' 27' ' ' ILE . 2.9 t30 -73.77 115.46 13.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.22 -0.659 . . . . 73.310000000000002 109.22 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -50.18 -41.6 49.65 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.794 1.035 . . . . 74.450000000000003 113.794 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -97.5 2.44 50.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.111 0.782 . . . . 73.340000000000003 113.111 -171.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.615 HG13 HD21 ' A' ' 24' ' ' ASN . 7.7 mt -104.66 157.54 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.568 -0.53 . . . . 73.450000000000003 109.568 178.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -96.45 167.61 11.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.555 -0.535 . . . . 74.209999999999994 109.555 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.409 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 5.7 m -60.52 -32.12 71.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.016 0.436 . . . . 73.310000000000002 109.871 174.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.683 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -59.46 -38.21 93.19 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.258 -0.883 . . . . 63.409999999999997 113.714 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -64.91 -36.79 85.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.163 0.506 . . . . 72.129999999999995 110.439 -176.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 17.8 t -73.74 -39.14 52.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.866 -0.607 . . . . 72.150000000000006 110.199 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m -59.56 -41.85 91.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.236 0.541 . . . . 71.019999999999996 110.248 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 37' ' ' MET . . . -69.4 -29.92 67.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.641 -0.709 . . . . 71.530000000000001 110.938 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.2 m -65.18 -38.08 89.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.021 0.439 . . . . 73.409999999999997 109.911 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.829 ' HB3' HD11 ' B' ' 240' ' ' LEU . 1.6 t80 -67.99 -34.37 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.849 -0.614 . . . . 74.530000000000001 109.753 177.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.767 ' HE3' HD23 ' B' ' 240' ' ' LEU . 0.8 OUTLIER -61.71 -53.49 55.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.364 -0.834 . . . . 74.0 110.762 177.156 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.46 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 24.2 t-105 -64.89 -40.24 94.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 74.230000000000004 111.012 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.38 93.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.343 -0.39 . . . . 72.450000000000003 111.241 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 48.3 tp -61.98 -38.18 87.6 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.593 -0.276 . . . . 75.299999999999997 110.285 178.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.463 ' HA ' HD11 ' B' ' 277' ' ' LEU . . . -61.82 -46.07 91.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 70.519999999999996 110.711 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -66.86 -39.75 87.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.191 -0.459 . . . . 73.439999999999998 111.059 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.713 ' HD2' HG23 ' B' ' 215' ' ' ILE . 11.0 t80 -76.94 -33.93 57.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.372 -0.377 . . . . 74.230000000000004 110.853 -176.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 9.8 t-20 -73.02 -43.3 62.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.217 -0.447 . . . . 75.140000000000001 110.759 -176.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.461 ' HB1' HD12 ' B' ' 277' ' ' LEU . . . -67.67 -18.61 65.0 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.175 -0.466 . . . . 71.530000000000001 111.335 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -59.01 -30.62 68.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.978 -0.555 . . . . 75.129999999999995 110.496 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -83.91 -10.11 58.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 73.109999999999999 111.282 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.535 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -66.77 -24.02 72.64 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.466 -0.873 . . . . 75.099999999999994 111.383 176.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 79.3 p -69.92 -15.15 63.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 63.109999999999999 111.355 -178.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.9 t -114.47 13.26 17.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 72.230000000000004 110.855 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -72.04 -35.09 69.25 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 116.505 -0.316 . . . . 53.310000000000002 111.501 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.635 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.2 m-85 -147.92 178.74 8.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.409 0.623 . . . . 63.020000000000003 112.387 -178.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.579 ' HG3' HG22 ' A' ' 54' ' ' THR . 15.1 pt-20 -91.7 -34.58 14.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.766 -1.107 . . . . 72.349999999999994 110.798 -171.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.607 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 80.5 p -124.71 159.3 31.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.498 -0.774 . . . . 74.409999999999997 109.219 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.639 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 6.6 pttm -78.67 -23.6 45.61 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.424 -0.51 . . . . 71.519999999999996 110.557 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.607 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.6 mp0 -61.34 -40.73 95.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.256 0.55 . . . . 74.450000000000003 109.808 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.753 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 21.1 mt-30 -83.52 -40.83 18.67 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.514 -0.766 . . . . 65.120000000000005 109.684 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.639 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 17.1 ttt -57.21 -44.55 83.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.755 -0.657 . . . . 73.010000000000005 111.605 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.594 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.3 tt0 -59.95 -39.34 85.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.343 -0.389 . . . . 72.129999999999995 111.052 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.68 -0.09 19.51 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.998 -0.547 . . . . 73.140000000000001 111.24 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.753 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.7 mmmt -112.47 -6.62 13.97 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.55 -0.295 . . . . 72.219999999999999 111.24 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.731 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 34.2 pttt -63.87 -43.34 96.38 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 119.996 -0.682 . . . . 72.019999999999996 110.146 -176.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.566 ' O ' ' HB2' ' A' ' 67' ' ' ASP . 21.5 mm-40 -83.16 3.19 31.89 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.033 0.444 . . . . 73.239999999999995 111.168 177.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.41 ' CD ' ' HZ1' ' A' ' 61' ' ' LYS . 34.6 mt-10 -97.47 -32.83 11.63 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.651 -0.704 . . . . 73.310000000000002 110.426 171.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.731 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 16.7 ptp -85.15 -35.26 21.84 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.682 -0.859 . . . . 73.430000000000007 108.682 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.582 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 69.0 mtp -80.64 -18.83 46.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.727 -0.669 . . . . 74.349999999999994 111.091 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.566 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 22.7 t70 -47.74 -45.75 29.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.672 0.608 . . . . 75.340000000000003 111.038 -178.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -108.15 -4.92 17.23 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.399 -0.819 . . . . 73.430000000000007 111.115 -176.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.623 ' HD2' HD22 ' B' ' 277' ' ' LEU . 1.8 m-30 -59.22 -48.26 82.28 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 121.305 -0.158 . . . . 73.409999999999997 111.05 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.543 ' HE3' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.08 -51.58 63.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.166 0.507 . . . . 54.43 110.206 175.892 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.452 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 1.9 t70 -90.7 22.74 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.65 -0.704 . . . . 74.239999999999995 111.291 -171.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.571 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 3.2 mmm180 -84.71 -44.93 12.92 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.209 0.528 . . . . 74.120000000000005 110.251 -176.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.715 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -95.44 15.09 20.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.663 -0.699 . . . . 72.530000000000001 109.929 -179.107 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.452 ' HD2' ' OD2' ' A' ' 71' ' ' ASP . 20.0 tttp -56.15 -61.87 2.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.377 -0.829 . . . . 74.150000000000006 110.345 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -67.38 -31.12 71.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.669 -0.696 . . . . 73.219999999999999 110.977 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.8 mtt -62.04 -38.86 90.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.349 0.595 . . . . 74.140000000000001 109.816 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.709 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.6 tt -73.55 -42.28 61.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.298 -0.865 . . . . 74.209999999999994 109.499 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.474 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 4.9 t70 -57.67 -42.04 82.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.447 -0.797 . . . . 73.230000000000004 110.831 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.59 -16.05 59.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.416 -0.811 . . . . 61.039999999999999 112.233 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -105.06 -16.07 14.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.844 0.354 . . . . 73.439999999999998 110.492 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.532 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 14.0 mmt -67.6 -63.02 1.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.906 -0.588 . . . . 74.5 111.55 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.622 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 8.3 pt-20 -80.6 1.85 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.835 0.68 . . . . 72.409999999999997 112.835 -170.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.39 -49.67 76.91 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.152 -0.684 . . . . 70.129999999999995 109.152 171.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -72.86 -38.26 67.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.482 -0.781 . . . . 72.430000000000007 110.189 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.718 HG21 ' HB2' ' B' ' 259' ' ' GLN . 66.7 mt -58.97 -54.25 36.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.523 -0.762 . . . . 74.450000000000003 111.941 -176.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.622 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.1 pt-20 -66.48 -12.15 55.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.652 0.263 . . . . 72.519999999999996 111.673 -177.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -110.57 11.4 22.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.668 -0.242 . . . . 74.310000000000002 111.4 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.467 ' CE2' ' HA ' ' B' ' 254' ' ' THR . 8.5 t80 -52.71 -56.37 16.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.282 . . . . 74.340000000000003 110.294 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.913 -0.585 . . . . 74.040000000000006 110.911 -179.625 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.8 p-10 . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 120.634 0.255 . . . . 75.109999999999999 110.598 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -68.92 -77.69 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.016 0.436 . . . . 75.5 110.162 175.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -128.51 -31.15 2.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 74.230000000000004 110.323 176.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -86.68 179.35 6.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.733 -0.667 . . . . 54.299999999999997 111.339 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.522 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -79.68 43.93 0.6 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.433 -0.803 . . . . 75.420000000000002 112.674 -174.264 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.75 -43.39 85.37 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.667 0.247 . . . . 72.310000000000002 111.667 -177.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.96 -14.88 62.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.033 0.444 . . . . 71.310000000000002 111.447 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.522 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 1.4 mmp_? -91.0 -62.16 1.51 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.343 -0.39 . . . . 74.340000000000003 110.17 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.793 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -55.37 -25.77 37.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.699 0.629 . . . . 55.229999999999997 112.699 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 212' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -67.97 -21.16 65.09 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.764 0.316 . . . . 73.5 110.946 -178.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -84.64 -27.58 27.06 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.619 -0.511 . . . . 74.319999999999993 109.619 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.793 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -62.44 -41.32 98.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.514 -0.767 . . . . 75.239999999999995 109.43 176.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.713 HG23 ' HD2' ' A' ' 43' ' ' TYR . 87.5 mt -68.8 -22.83 26.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.204 -0.907 . . . . 73.239999999999995 111.027 178.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' B' ' 212' ' ' THR . 30.6 mmmt -66.58 -40.42 88.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 73.340000000000003 111.603 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -62.47 -35.98 81.04 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.058 -0.719 . . . . 75.430000000000007 109.058 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . 0.413 ' O ' HG13 ' B' ' 232' ' ' VAL . . . -67.84 -37.42 81.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.731 -0.668 . . . . 71.530000000000001 110.145 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 29.2 m-80 -74.37 -6.49 48.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.99 -0.55 . . . . 72.099999999999994 111.509 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -93.98 -32.81 13.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.368 . . . . 74.219999999999999 110.789 175.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -75.78 -27.09 57.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.508 0.671 . . . . 74.120000000000005 109.689 175.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . 0.402 HD22 HG22 ' B' ' 229' ' ' THR . 3.5 t-20 -71.72 -12.76 61.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.985 -1.007 . . . . 74.409999999999997 110.481 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 86.9 mm-40 -75.22 -15.04 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.102 -0.499 . . . . 73.430000000000007 111.578 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.728 HD21 HG13 ' B' ' 227' ' ' ILE . 7.1 t30 -71.56 122.45 20.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.189 0.519 . . . . 54.25 109.719 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -65.66 -30.28 70.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.241 -0.89 . . . . 74.25 112.162 -174.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.14 -1.33 45.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.443 0.534 . . . . 71.329999999999998 112.443 -172.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.728 HG13 HD21 ' B' ' 224' ' ' ASN . 8.9 mt -99.2 148.63 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.358 -0.608 . . . . 75.329999999999998 109.358 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.792 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 42.7 mt-30 -78.21 147.38 34.47 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.859 -0.609 . . . . 75.230000000000004 109.865 178.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 229' ' ' THR . . . . . 0.402 HG22 HD22 ' B' ' 222' ' ' ASN . 3.8 m -59.82 -34.63 73.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.041 0.448 . . . . 73.319999999999993 110.662 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.28 87.68 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.861 -0.609 . . . . 75.25 113.816 -176.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.792 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 16.8 mm-40 -80.49 -29.52 37.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.842 0.821 . . . . 74.219999999999999 109.674 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . 0.413 HG13 ' O ' ' B' ' 218' ' ' ALA . 27.7 t -77.35 -41.34 29.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.27 -0.877 . . . . 75.230000000000004 110.938 -176.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.8 p -62.27 -40.16 95.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 72.109999999999999 110.816 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.45 75.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.899 -0.591 . . . . 74.310000000000002 110.934 179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 64.0 m -65.06 -34.24 77.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 71.239999999999995 110.715 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.543 ' CD1' HD12 ' A' ' 14' ' ' LEU . 5.3 t80 -65.83 -36.65 84.07 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.309 0.576 . . . . 72.239999999999995 109.808 178.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.715 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.6 ttm -69.52 -48.39 60.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.751 -0.658 . . . . 64.030000000000001 111.547 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.462 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 34.9 t-105 -63.33 -35.04 79.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.327 . . . . 72.519999999999996 110.782 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.489 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -64.95 -40.49 95.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 75.120000000000005 110.894 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.829 HD11 ' HB3' ' A' ' 36' ' ' PHE . 43.8 tp -69.1 -32.13 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.979 0.418 . . . . 74.340000000000003 110.399 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.432 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -63.06 -41.4 99.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.901 -0.591 . . . . 63.140000000000001 110.829 178.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -75.3 -26.65 58.88 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.15 0.5 . . . . 74.319999999999993 110.275 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -81.4 -36.52 29.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.716 -0.674 . . . . 74.439999999999998 110.854 -176.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -74.76 -27.82 60.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.659 0.266 . . . . 72.319999999999993 111.376 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . 0.532 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -71.98 -16.0 62.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.243 0.544 . . . . 65.129999999999995 111.105 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -55.88 -33.68 64.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 73.310000000000002 110.256 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.683 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 56.3 m-85 -71.63 -13.59 61.8 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.019 -0.537 . . . . 74.450000000000003 112.173 -177.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.582 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -60.47 -35.0 87.82 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.254 -0.974 . . . . 74.239999999999995 111.489 177.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 6.1 m -59.96 -30.96 69.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.814 0.34 . . . . 75.099999999999994 111.732 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.0 t -102.26 16.86 24.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.056 0.455 . . . . 73.340000000000003 111.038 -176.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 22.9 t -78.01 -66.05 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.323 -0.399 . . . . 72.030000000000001 110.89 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.61 ' CD1' ' HG3' ' B' ' 261' ' ' LYS . 2.4 m-85 -135.15 -169.99 2.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.293 0.568 . . . . 74.420000000000002 112.511 -174.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.717 ' HG3' ' H ' ' B' ' 254' ' ' THR . 5.4 pt-20 -95.82 -61.16 1.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.854 -1.066 . . . . 71.150000000000006 110.154 -177.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.717 ' H ' ' HG3' ' B' ' 253' ' ' GLU . 74.8 p -89.81 154.41 19.92 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.89 -0.596 . . . . 74.120000000000005 110.461 -177.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.429 ' HE2' ' HB2' ' B' ' 255' ' ' LYS . 10.4 ptmm? -71.5 -26.82 62.84 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.753 -0.379 . . . . 72.510000000000005 110.534 -177.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.8 -51.18 70.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.045 -0.525 . . . . 71.340000000000003 110.402 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.638 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 20.5 mt-30 -77.47 -40.72 42.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 64.409999999999997 110.063 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.582 ' HE2' ' O ' ' B' ' 248' ' ' GLY . 21.5 ttt -57.79 -40.66 80.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.433 -0.803 . . . . 64.540000000000006 111.179 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.718 ' HB2' HG21 ' A' ' 85' ' ' ILE . 30.1 tt0 -71.34 -29.44 64.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.443 . . . . 74.209999999999994 111.44 -178.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.25 -15.54 59.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.011 0.434 . . . . 73.150000000000006 110.872 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.638 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.9 mmmt -95.66 -7.59 37.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.281 -0.418 . . . . 75.109999999999999 111.414 -174.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.702 ' HA ' ' HE1' ' B' ' 265' ' ' MET . 56.6 pttt -58.14 -47.08 84.43 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.432 -0.349 . . . . 71.439999999999998 110.763 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.544 ' O ' ' HB2' ' B' ' 267' ' ' ASP . 10.4 mm-40 -74.67 -16.05 60.78 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.461 -0.496 . . . . 72.200000000000003 111.623 -178.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -80.39 -32.59 37.53 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.779 -0.369 . . . . 74.5 110.407 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.702 ' HE1' ' HA ' ' B' ' 262' ' ' LYS . 15.3 ptp -89.73 -26.44 20.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.379 -0.6 . . . . 72.040000000000006 109.379 178.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.709 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 83.8 mtp -85.02 -20.68 30.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.788 -0.642 . . . . 62.119999999999997 111.615 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 9.0 t70 -52.35 -47.64 65.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.485 0.66 . . . . 75.200000000000003 110.404 -175.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.454 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 8.8 p90 -96.83 0.12 48.78 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.316 -0.856 . . . . 74.030000000000001 110.858 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.454 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.2 m-30 -68.39 -50.52 52.4 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.702 -0.851 . . . . 74.439999999999998 108.702 171.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.49 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -53.36 -55.94 20.81 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.589 -0.732 . . . . 74.019999999999996 109.868 171.347 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -95.65 74.2 3.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.468 0.651 . . . . 64.129999999999995 111.385 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 4.6 mtm180 -127.71 -38.41 1.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.862 -0.608 . . . . 71.510000000000005 109.819 168.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.734 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.84 11.78 36.16 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.157 -0.474 . . . . 73.019999999999996 110.874 -176.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -64.46 -53.14 52.92 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.679 -0.408 . . . . 74.430000000000007 110.811 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.55 -35.31 80.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 62.310000000000002 110.866 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 276' ' ' MET . . . . . 0.46 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 59.8 mtt -62.73 -43.65 98.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.628 0.727 . . . . 73.0 109.927 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.623 HD22 ' HD2' ' A' ' 69' ' ' TYR . 28.3 tp -70.25 -41.45 73.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.779 -1.101 . . . . 74.299999999999997 110.514 -178.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.14 -46.49 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.544 0.687 . . . . 52.409999999999997 110.102 178.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.08 -24.02 63.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.838 -1.073 . . . . 63.32 111.669 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.41 -32.15 22.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.998 -0.281 . . . . 73.319999999999993 110.654 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.568 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -60.55 -62.92 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.051 -0.522 . . . . 75.200000000000003 110.598 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 10.6 pt-20 -74.29 -7.27 52.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.857 -0.611 . . . . 74.329999999999998 112.154 -172.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -58.63 -48.04 82.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.149 0.5 . . . . 71.319999999999993 110.051 174.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -87.5 -15.63 37.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.308 -0.405 . . . . 73.549999999999997 111.197 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.594 HD13 ' HA ' ' A' ' 59' ' ' GLN . 57.5 mt -70.35 -55.95 12.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 C-N-CA 121.019 -0.272 . . . . 72.420000000000002 110.354 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.3 pt-20 -57.8 -30.49 65.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.81 0.338 . . . . 74.129999999999995 111.383 -178.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -94.4 6.75 47.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.334 -0.394 . . . . 75.230000000000004 111.61 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -57.81 -44.71 86.56 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.92 -0.4 . . . . 71.25 109.92 178.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.921 0.391 . . . . 72.219999999999999 110.757 176.42 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.4 p-10 . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.986 -0.376 . . . . 73.319999999999993 109.986 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -84.13 -77.29 0.27 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.58 -0.282 . . . . 61.240000000000002 111.253 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -105.34 -50.73 3.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.276 0.56 . . . . 70.519999999999996 109.845 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.557 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -97.28 161.52 13.76 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.476 -0.784 . . . . 64.319999999999993 110.863 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.443 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -78.75 53.76 1.41 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.832 -0.622 . . . . 62.340000000000003 112.091 -179.121 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 28.6 m-85 -53.79 -41.32 67.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.973 0.416 . . . . 71.409999999999997 110.961 -178.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.93 -5.02 31.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.8 -0.636 . . . . 71.329999999999998 112.24 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -99.37 -61.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.771 -0.455 . . . . 75.5 109.771 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.547 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -55.32 -23.51 24.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.731 -0.668 . . . . 71.030000000000001 112.682 -178.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.0 t -65.26 -25.58 67.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.473 0.178 . . . . 71.25 111.06 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.8 mt-10 -82.16 -33.23 29.62 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.519 0.676 . . . . 71.349999999999994 109.183 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.547 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.73 -45.15 91.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.913 -1.04 . . . . 72.299999999999997 109.443 177.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.506 HG21 ' HD2' ' B' ' 243' ' ' TYR . 71.9 mt -68.91 -31.38 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.615 -0.72 . . . . 75.209999999999994 110.682 176.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.48 -38.59 81.24 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.19 -0.459 . . . . 72.209999999999994 110.828 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.602 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 2.0 tm? -67.63 -39.74 84.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 64.540000000000006 110.135 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.574 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -61.2 -25.52 67.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.255 0.55 . . . . 71.549999999999997 110.739 177.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.407 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 22.8 m-80 -80.51 -19.97 44.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.987 -0.551 . . . . 71.329999999999998 110.141 178.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.602 ' HG2' ' HA ' ' A' ' 17' ' ' LEU . 27.6 mm-40 -68.33 -51.38 45.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.411 0.624 . . . . 72.239999999999995 109.522 177.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -73.82 -14.69 61.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.159 -0.928 . . . . 74.310000000000002 110.362 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -81.18 -11.64 59.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.744 -0.662 . . . . 63.350000000000001 110.854 -178.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 8.6 mm-40 -78.88 64.02 3.73 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.295 0.569 . . . . 73.219999999999999 110.352 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -147.55 149.36 32.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.502 -0.772 . . . . 74.510000000000005 109.053 -178.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.2 t -103.54 -31.77 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 111.979 0.362 . . . . 74.129999999999995 111.979 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -87.29 2.69 49.45 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.155 0.428 . . . . 73.299999999999997 112.155 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.92 148.93 16.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.8 -0.445 . . . . 73.200000000000003 109.8 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.482 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 2.3 mp0 -83.45 146.79 28.21 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.993 -0.548 . . . . 72.239999999999995 109.631 178.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 38.8 m -59.04 -34.79 72.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.125 0.488 . . . . 63.43 110.785 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.86 -11.57 73.94 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.746 -0.661 . . . . 73.140000000000001 113.32 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 13.3 mm-40 -74.54 -23.31 58.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.297 0.57 . . . . 74.400000000000006 110.037 -179.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.574 HG11 ' O ' ' A' ' 18' ' ' ALA . 21.2 t -87.3 -39.08 12.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.636 -0.711 . . . . 74.540000000000006 109.834 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -57.56 -42.05 82.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.688 -0.687 . . . . 73.040000000000006 110.746 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.11 -31.28 72.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 74.239999999999995 110.908 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 50.0 m -66.96 -32.3 73.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.159 0.504 . . . . 74.409999999999997 109.901 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.486 ' CD1' HD11 ' B' ' 214' ' ' LEU . 7.1 t80 -68.47 -37.68 80.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 74.109999999999999 109.854 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.751 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 8.5 ttm -66.86 -45.22 78.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 73.209999999999994 111.324 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.654 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 23.7 t-105 -63.1 -38.21 90.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.988 0.423 . . . . 75.129999999999995 110.565 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.509 ' HB1' ' HB3' ' B' ' 211' ' ' ALA . . . -66.39 -36.8 83.76 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.07 -0.514 . . . . 73.349999999999994 111.242 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 61.4 tp -67.68 -35.52 79.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.946 -0.391 . . . . 75.299999999999997 109.946 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.422 ' HB2' ' HA ' ' B' ' 277' ' ' LEU . . . -61.0 -43.59 98.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.81 -0.632 . . . . 73.209999999999994 110.9 178.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -69.88 -39.15 76.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.025 0.441 . . . . 75.129999999999995 110.708 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -72.41 -32.07 66.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.975 -0.557 . . . . 71.319999999999993 110.497 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB3' HD12 ' B' ' 277' ' ' LEU . 7.1 t-20 -77.31 -39.28 48.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.003 -0.544 . . . . 74.439999999999998 110.722 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.74 -27.59 69.3 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.12 0.486 . . . . 74.319999999999993 111.006 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 18.6 t90 -58.55 -27.77 64.88 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.253 -0.885 . . . . 74.129999999999995 111.072 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.83 -1.72 40.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.544 -0.298 . . . . 74.310000000000002 111.639 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.09 -27.53 69.06 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.463 -0.875 . . . . 72.299999999999997 111.37 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.415 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 33.9 p -67.34 -17.7 64.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 71.129999999999995 111.572 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 p -94.52 0.69 55.47 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.958 0.409 . . . . 74.120000000000005 110.894 -177.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.4 t -81.17 -39.03 26.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 63.109999999999999 111.59 -175.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -154.13 -179.05 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.246 0.461 . . . . 73.310000000000002 112.246 -175.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG3' ' N ' ' A' ' 54' ' ' THR . 8.9 pt-20 -101.79 -47.32 4.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.41 -0.814 . . . . 75.129999999999995 111.284 -176.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.442 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 51.9 p -96.41 154.77 17.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.511 -0.313 . . . . 72.230000000000004 110.358 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.497 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 17.1 ptmt -68.42 -31.16 70.3 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.844 -0.343 . . . . 75.129999999999995 110.287 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.442 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.7 mp0 -58.21 -52.24 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.281 0.562 . . . . 75.319999999999993 110.606 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.665 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 21.8 mt-30 -76.91 -36.64 56.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.746 -0.661 . . . . 71.540000000000006 110.541 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.415 ' HE2' ' HA ' ' A' ' 49' ' ' SER . 22.7 ttt -64.86 -43.36 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 74.109999999999999 111.092 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.589 ' HG3' ' HZ1' ' A' ' 62' ' ' LYS . 32.5 tt0 -61.56 -38.68 88.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.021 -0.536 . . . . 74.230000000000004 111.406 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.21 -8.7 57.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.714 -175.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.665 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.2 mmmm -104.02 -0.24 29.05 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 120.881 -0.328 . . . . 73.329999999999998 111.119 -175.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.589 ' HZ1' ' HG3' ' A' ' 59' ' ' GLN . 6.6 ptpp? -59.52 -48.44 81.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.695 -0.402 . . . . 73.120000000000005 110.607 -176.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.583 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.1 tp60 -73.4 -24.52 60.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.961 -0.385 . . . . 64.319999999999993 109.961 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -71.35 -43.45 66.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 74.299999999999997 111.19 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.58 ' HE1' ' HA ' ' A' ' 62' ' ' LYS . 22.2 ptp -75.19 -34.34 61.51 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.911 -0.774 . . . . 63.109999999999999 108.911 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.601 ' HE3' ' HB2' ' B' ' 278' ' ' ASP . 63.9 mtp -82.15 1.28 37.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.508 -0.769 . . . . 75.010000000000005 111.289 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 26.1 t0 -78.86 -27.47 44.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.987 0.422 . . . . 75.329999999999998 110.512 -175.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.617 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 24.6 p90 -119.38 -8.59 10.03 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.652 -0.419 . . . . 75.510000000000005 111.258 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.2 m-30 -54.57 -48.34 72.2 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.625 0.25 . . . . 75.400000000000006 111.472 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.781 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -52.3 -57.54 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.994 -0.548 . . . . 74.450000000000003 111.54 177.875 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.468 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 9.1 t70 -91.47 62.74 4.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.952 -0.567 . . . . 62.329999999999998 111.066 -172.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 4.2 mmp_? -120.12 -38.01 2.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 75.450000000000003 110.923 175.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.799 ' HE1' ' HA ' ' B' ' 270' ' ' MET . 0.1 OUTLIER -90.22 12.2 18.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.129 0.49 . . . . 73.140000000000001 109.726 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -51.81 -66.86 0.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.834 -1.076 . . . . 73.329999999999998 111.098 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.0 -23.16 64.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.75 -0.659 . . . . 73.430000000000007 112.266 -174.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.44 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 28.2 mtm -78.13 -28.14 48.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.297 0.57 . . . . 75.530000000000001 109.619 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.753 HD21 ' HE3' ' A' ' 81' ' ' MET . 6.6 tt -76.08 -37.59 58.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.438 -0.801 . . . . 75.209999999999994 108.887 174.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.644 ' HB2' ' HE2' ' B' ' 266' ' ' MET . 11.3 t70 -55.76 -39.33 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.055 -0.975 . . . . 71.420000000000002 111.069 178.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.96 -20.32 66.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.283 -0.871 . . . . 73.019999999999996 111.974 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -104.3 -4.47 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 121.065 -0.254 . . . . 63.25 111.382 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.753 ' HE3' HD21 ' A' ' 77' ' ' LEU . 9.5 mmt -71.56 -35.41 70.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.637 -0.256 . . . . 72.049999999999997 111.611 -178.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.896 ' HA ' HD13 ' A' ' 85' ' ' ILE . 41.2 mt-10 -72.58 4.03 4.34 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.003 0.371 . . . . 74.219999999999999 112.003 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.531 ' O ' ' HB2' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.34 127.2 30.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.401 -0.592 . . . . 63.020000000000003 109.401 170.848 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.531 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 23.0 m-85 77.5 -0.12 2.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.83 -1.077 . . . . 74.519999999999996 110.997 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.896 HD13 ' HA ' ' A' ' 82' ' ' GLU . 11.2 mt -92.68 -66.02 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.108 -0.496 . . . . 75.310000000000002 109.687 176.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.26 -18.54 65.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.269 0.557 . . . . 74.109999999999999 110.151 176.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -100.8 0.6 39.02 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.617 -0.72 . . . . 73.5 111.152 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.76 -47.6 85.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 120.589 0.233 . . . . 75.540000000000006 110.614 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 62.109999999999999 111.412 178.983 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.569 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 84.4 m-20 . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 121.221 0.534 . . . . 72.239999999999995 111.482 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -120.68 -58.69 1.81 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.32 -0.855 . . . . 75.239999999999995 109.677 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -122.03 -49.06 2.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.104 0.478 . . . . 73.129999999999995 110.28 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.485 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -99.85 166.63 10.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.798 -0.637 . . . . 73.239999999999995 111.74 -177.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.569 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -78.84 53.99 1.47 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 74.040000000000006 111.708 178.126 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -54.49 -45.6 73.28 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 72.209999999999994 111.753 -176.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.5 -15.34 62.56 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.431 0.53 . . . . 70.019999999999996 112.431 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -87.74 -62.33 1.52 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.576 0.227 . . . . 75.129999999999995 110.506 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.791 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -57.6 -18.91 22.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.877 0.695 . . . . 72.219999999999999 112.877 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 212' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 13.6 t -66.76 -23.16 66.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.695 0.284 . . . . 73.019999999999996 110.738 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.444 ' HB2' HD13 ' A' ' 17' ' ' LEU . 79.4 mt-10 -84.55 -27.46 27.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.387 0.613 . . . . 71.530000000000001 109.379 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.791 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -67.23 -47.27 71.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.202 -0.908 . . . . 73.019999999999996 109.598 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 74.6 mt -68.9 -30.92 48.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.661 -0.699 . . . . 74.549999999999997 110.27 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' B' ' 212' ' ' THR . 10.2 tmtt? -56.31 -40.03 73.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.796 -0.638 . . . . 74.439999999999998 110.88 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -64.61 -45.21 87.9 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.576 -0.527 . . . . 73.409999999999997 109.576 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.85 -37.08 78.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.98 -0.555 . . . . 72.319999999999993 110.835 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -74.52 11.56 0.98 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.053 -0.521 . . . . 71.219999999999999 111.757 178.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.11 -37.72 6.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.16 0.505 . . . . 73.409999999999997 109.733 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -76.83 -38.32 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 71.540000000000006 110.835 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . 0.549 ' ND2' ' HA ' ' B' ' 229' ' ' THR . 3.8 t-20 -71.29 -14.59 62.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.63 -0.714 . . . . 71.219999999999999 111.55 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -74.71 1.22 12.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.453 -0.34 . . . . 65.129999999999995 111.315 -176.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.525 HD21 HG13 ' B' ' 227' ' ' ILE . 1.4 t30 -77.69 103.95 7.94 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.61 -0.885 . . . . 72.200000000000003 108.61 174.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.9 t -58.64 -36.66 74.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.594 -0.73 . . . . 73.450000000000003 112.888 -172.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -82.57 9.55 9.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.964 0.357 . . . . 74.319999999999993 111.964 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.525 HG13 HD21 ' B' ' 224' ' ' ASN . 4.5 mt -117.28 152.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 109.768 -0.456 . . . . 72.319999999999993 109.768 175.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.0 154.43 28.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.087 -0.506 . . . . 71.239999999999995 110.169 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 229' ' ' THR . . . . . 0.549 ' HA ' ' ND2' ' B' ' 222' ' ' ASN . 5.5 m -64.43 -30.81 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.978 0.418 . . . . 65.540000000000006 110.501 179.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -68.05 -18.15 70.58 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.825 -0.625 . . . . 75.25 113.318 -178.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -71.23 -20.21 62.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.991 0.424 . . . . 72.049999999999997 111.078 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . 0.448 HG21 ' CA ' ' B' ' 222' ' ' ASN . 28.6 t -99.12 -36.76 5.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.085 -0.507 . . . . 75.310000000000002 110.478 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 35.9 p -64.16 -40.99 97.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.03 0.443 . . . . 64.310000000000002 110.52 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.38 73.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.989 -0.55 . . . . 61.439999999999998 110.554 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.401 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 56.4 m -68.12 -36.49 79.82 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.744 -0.465 . . . . 54.0 109.744 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.518 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.53 -40.73 85.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.751 -0.659 . . . . 75.450000000000003 109.58 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.794 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 14.8 ttm -66.25 -44.13 84.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.685 -0.689 . . . . 74.319999999999993 111.457 178.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.443 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 22.7 t-105 -64.31 -38.91 92.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.329999999999998 110.445 176.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.501 ' HB2' ' HB2' ' A' ' 11' ' ' ALA . . . -64.7 -39.08 93.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 111.065 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.17 -35.83 78.65 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.615 -0.513 . . . . 74.409999999999997 109.615 177.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.408 ' HB3' ' HB2' ' A' ' 73' ' ' TYR . . . -62.88 -30.65 71.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.175 -0.466 . . . . 62.119999999999997 111.406 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -88.59 -33.25 17.74 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.871 -0.332 . . . . 74.040000000000006 110.949 179.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.506 ' HD2' HG21 ' A' ' 15' ' ' ILE . 10.7 t80 -81.56 -39.64 24.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.392 -0.367 . . . . 72.400000000000006 111.233 -175.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -78.82 -17.43 55.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.047 0.451 . . . . 75.099999999999994 110.975 -175.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -74.75 -13.95 60.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.233 0.539 . . . . 72.420000000000002 110.57 177.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -60.63 -25.93 66.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.513 -0.767 . . . . 71.540000000000006 110.533 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -72.77 -8.63 56.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.862 -0.608 . . . . 73.450000000000003 111.762 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.73 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.03 -36.4 67.34 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.508 -0.853 . . . . 74.219999999999999 111.816 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 43.9 p -69.8 -13.63 62.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.815 0.34 . . . . 75.120000000000005 111.831 -177.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 40.0 p -93.03 -9.82 38.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.39 . . . . 72.409999999999997 110.784 -178.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.7 t -76.5 -36.56 57.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.244 -0.435 . . . . 51.530000000000001 110.772 -175.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -148.88 -178.5 6.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.126 0.489 . . . . 72.120000000000005 111.919 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.512 ' HG3' HG22 ' B' ' 254' ' ' THR . 10.3 pt-20 -103.93 -33.41 8.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.136 -0.938 . . . . 74.310000000000002 111.779 -172.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.529 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 43.2 p -115.09 158.48 22.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.869 -0.605 . . . . 75.450000000000003 110.158 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.77 -36.06 79.81 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 121.052 -0.259 . . . . 72.109999999999999 110.792 -178.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . 0.529 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.6 mp0 -58.27 -50.97 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.282 0.563 . . . . 73.25 110.188 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.601 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 23.9 mt-30 -73.05 -40.86 64.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.471 -0.786 . . . . 75.209999999999994 110.82 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.592 ' HE3' ' C ' ' B' ' 248' ' ' GLY . 20.1 ttt -63.88 -47.38 80.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 74.319999999999993 111.24 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.543 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.7 tt0 -62.0 -34.48 76.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 72.340000000000003 110.909 -178.191 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.32 -6.77 48.24 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.113 -0.494 . . . . 45.240000000000002 111.58 -178.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 13.9 mmmm -114.59 5.49 15.47 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 122.362 -0.211 . . . . 62.450000000000003 110.608 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.613 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 1.6 ptpp? -52.55 -48.34 66.19 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 123.314 0.384 . . . . 64.409999999999997 110.785 -177.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.421 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 16.1 tp60 -77.78 -28.36 50.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.99 0.424 . . . . 74.219999999999999 110.055 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.67 -38.17 83.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.748 -0.66 . . . . 72.219999999999999 111.187 -177.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.73 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 16.8 ptp -84.44 -26.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.307 0.575 . . . . 74.109999999999999 109.83 -177.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.644 ' HE2' ' HB2' ' A' ' 78' ' ' ASP . 75.0 mtp -79.1 -20.46 48.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.643 -0.708 . . . . 74.530000000000001 111.758 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.41 -34.95 74.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 75.200000000000003 111.369 -168.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -102.79 -10.61 18.97 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.787 -0.365 . . . . 74.439999999999998 111.179 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -60.35 -48.13 83.08 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.477 0.18 . . . . 71.329999999999998 111.173 -178.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.799 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -51.65 -51.77 53.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.059 -0.519 . . . . 75.519999999999996 111.088 177.067 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . 0.645 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 10.4 t70 -92.2 28.75 1.81 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.831 -0.622 . . . . 45.109999999999999 111.558 -171.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -84.28 -48.28 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.945 -0.472 . . . . 73.540000000000006 110.765 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.781 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -83.85 10.49 9.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.113 -0.494 . . . . 74.510000000000005 110.981 -174.822 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.735 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 14.4 tttp -56.07 -60.57 3.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.946 -0.57 . . . . 75.409999999999997 110.782 -177.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . 0.465 ' HG3' ' N ' ' B' ' 276' ' ' MET . 6.0 pt-20 -56.82 -39.83 74.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.602 -0.726 . . . . 74.120000000000005 111.842 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 276' ' ' MET . . . . . 0.654 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 49.3 mtm -74.66 -26.21 59.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.044 0.45 . . . . 52.509999999999998 110.548 -176.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.458 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 5.2 tt -72.41 -41.69 65.96 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.711 -0.848 . . . . 75.549999999999997 108.711 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.601 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 8.7 t70 -61.37 -38.68 87.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.237 -0.892 . . . . 71.019999999999996 110.815 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -64.39 -17.35 63.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.656 -0.702 . . . . 52.340000000000003 111.779 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -101.09 -3.37 29.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.758 0.313 . . . . 71.530000000000001 111.283 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 20.1 mmt -76.38 -176.03 3.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.242 -0.435 . . . . 73.420000000000002 110.675 176.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.733 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 4.0 mm-40 61.54 14.81 6.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.483 -0.78 . . . . 75.109999999999999 111.901 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -66.76 -58.84 4.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.201 -0.454 . . . . 63.539999999999999 110.676 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -89.29 -7.46 55.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.977 0.417 . . . . 73.239999999999995 110.002 174.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.733 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 42.7 mt -75.44 -57.88 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.087 -0.506 . . . . 74.319999999999993 111.318 -175.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.5 pt-20 -73.03 -16.71 61.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.838 0.351 . . . . 72.530000000000001 110.595 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -109.19 22.19 16.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.289 -0.414 . . . . 74.299999999999997 110.516 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.497 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 25.3 t80 -58.6 -56.78 17.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.47 -0.332 . . . . 75.329999999999998 110.826 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.536 -0.302 . . . . 73.519999999999996 111.364 -179.101 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.665 ' HA ' ' HB2' ' A' ' 8' ' ' TYR . 1.6 p-10 . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.759 -0.83 . . . . 74.310000000000002 108.759 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . 0.429 ' H ' ' HD2' ' A' ' 8' ' ' TYR . 24.8 mt-10 -104.33 79.08 1.55 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.25 -0.432 . . . . 71.040000000000006 111.544 -175.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.43 24.67 8.77 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.125 0.965 . . . . 75.219999999999999 108.735 175.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -158.3 174.91 14.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.41 -1.268 . . . . 74.230000000000004 110.222 -171.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.434 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -91.49 42.4 1.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.308 -0.405 . . . . 74.439999999999998 111.526 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.665 ' HB2' ' HA ' ' A' ' 3' ' ' ASN . 44.5 m-85 -53.34 -46.3 69.46 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.413 -0.358 . . . . 74.510000000000005 111.193 178.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.12 -14.91 62.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.95 -0.568 . . . . 55.229999999999997 111.914 -178.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 0.6 OUTLIER -95.36 -58.02 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.257 -0.275 . . . . 74.040000000000006 110.257 178.905 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.834 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -57.16 -23.14 45.44 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.688 0.625 . . . . 73.519999999999996 112.688 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 t -65.39 -24.01 67.11 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.941 0.401 . . . . 72.409999999999997 110.801 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 35.9 mt-10 -81.34 -23.28 37.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.332 0.586 . . . . 73.209999999999994 109.878 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.834 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -71.14 -41.68 70.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.333 -0.848 . . . . 75.030000000000001 109.591 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.413 HG21 ' HD2' ' B' ' 243' ' ' TYR . 71.4 mt -72.67 -20.58 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.657 -0.701 . . . . 75.310000000000002 110.192 177.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 15.7 mmmt -57.96 -40.08 79.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.708 -0.678 . . . . 74.230000000000004 111.851 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.7 tm? -74.98 -29.73 60.98 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.267 0.556 . . . . 72.439999999999998 109.527 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.415 ' O ' HG13 ' A' ' 32' ' ' VAL . . . -70.4 -42.95 71.02 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.585 -0.734 . . . . 71.519999999999996 110.698 -175.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.647 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.8 m-20 -57.05 -42.45 80.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.893 -0.594 . . . . 72.219999999999999 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.92 -33.96 75.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.939 -0.573 . . . . 75.519999999999996 111.745 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -77.62 -27.99 51.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.001 0.429 . . . . 74.200000000000003 110.199 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.593 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 3.4 t-20 -74.7 -20.28 59.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.94 -0.573 . . . . 74.140000000000001 110.383 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.647 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 9.9 mm-40 -71.91 -15.58 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.962 -0.563 . . . . 64.219999999999999 111.296 -178.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.637 ' HB3' HG13 ' A' ' 27' ' ' ILE . 10.7 t30 -66.69 123.51 20.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.963 0.411 . . . . 74.299999999999997 110.569 -177.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.2 t -56.98 -37.2 71.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.368 -0.833 . . . . 75.439999999999998 113.039 -175.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -82.74 -24.09 33.71 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.852 0.316 . . . . 75.0 111.852 -173.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.637 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.5 mt -90.68 145.11 7.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.095 0.474 . . . . 72.420000000000002 110.276 -174.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.693 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 33.4 mt-30 -83.73 152.65 24.59 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.322 -0.854 . . . . 74.329999999999998 109.358 177.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.593 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 30.2 m -58.3 -37.7 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.033 0.445 . . . . 72.0 110.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.827 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -69.39 -19.08 74.08 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.6 -0.727 . . . . 73.420000000000002 114.078 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.693 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 33.7 mm-40 -74.92 -36.09 62.17 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 117.588 0.694 . . . . 71.310000000000002 109.606 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.476 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.5 t -71.92 -41.04 69.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.312 -0.858 . . . . 74.420000000000002 110.353 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -59.38 -37.08 77.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.714 -0.675 . . . . 73.209999999999994 110.369 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.64 -31.48 65.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.798 -0.637 . . . . 72.010000000000005 110.872 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.479 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 10.3 t -68.33 -37.54 80.64 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.694 -0.484 . . . . 72.0 109.694 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.599 ' HD1' HD11 ' B' ' 214' ' ' LEU . 13.7 t80 -66.89 -37.47 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 74.450000000000003 109.545 176.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.706 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.4 ttm -67.33 -46.63 72.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 64.040000000000006 111.412 178.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.628 ' HE3' ' HB3' ' B' ' 276' ' ' MET . 35.8 t-105 -62.24 -39.93 94.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.739 0.304 . . . . 73.420000000000002 110.727 177.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.522 ' HB3' ' HB2' ' B' ' 211' ' ' ALA . . . -63.14 -37.89 88.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.362 -0.381 . . . . 74.439999999999998 111.038 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.741 HD23 ' SD ' ' B' ' 237' ' ' MET . 56.4 tp -64.94 -37.93 89.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 120.955 0.407 . . . . 74.409999999999997 110.075 178.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.549 ' HB1' ' HA ' ' B' ' 277' ' ' LEU . . . -63.16 -35.41 80.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.797 -0.638 . . . . 74.430000000000007 111.25 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 38' ' ' TRP . 55.9 mtp180 -74.81 -37.45 62.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.258 0.551 . . . . 74.120000000000005 110.142 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -77.39 -41.25 40.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.471 -0.786 . . . . 75.530000000000001 110.911 -175.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -66.05 -34.74 78.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.945 -0.57 . . . . 72.5 110.862 -175.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.414 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -62.37 -11.07 13.44 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.851 -0.613 . . . . 71.209999999999994 112.471 -177.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -63.27 -26.99 69.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.666 0.27 . . . . 73.329999999999998 111.087 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -66.53 -11.87 54.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.446 -0.343 . . . . 65.400000000000006 111.856 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.449 ' O ' ' HE3' ' A' ' 58' ' ' MET . . . -60.48 -28.01 66.78 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.274 -0.965 . . . . 75.430000000000007 111.233 174.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.9 m -64.17 -15.83 60.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.474 0.31 . . . . 73.540000000000006 111.657 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.9 t -119.15 22.19 11.95 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.153 0.501 . . . . 72.140000000000001 110.698 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.1 t -84.59 -60.88 1.93 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.45 -0.341 . . . . 74.329999999999998 110.814 178.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.519 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.8 m-85 -146.48 -175.29 4.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.814 0.34 . . . . 75.319999999999993 111.387 -177.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -102.1 -33.13 9.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.575 -0.739 . . . . 65.019999999999996 111.241 -174.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 p -113.01 153.02 28.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.897 -0.592 . . . . 73.010000000000005 110.804 -178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -67.37 -34.04 76.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.403 -0.362 . . . . 70.239999999999995 110.755 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.23 -36.44 84.15 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.247 -0.433 . . . . 75.030000000000001 111.001 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.647 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 mt-30 -84.84 -40.16 17.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.448 -0.342 . . . . 74.409999999999997 110.468 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.459 ' SD ' HG12 ' B' ' 285' ' ' ILE . 19.4 ttt -64.4 -45.1 89.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.234 -0.439 . . . . 73.010000000000005 111.425 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.584 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.2 tt0 -64.25 -33.44 75.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 73.439999999999998 110.993 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.47 -17.84 62.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.238 -0.437 . . . . 75.209999999999994 110.898 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.3 mmmt -100.44 -2.3 33.62 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.262 -0.426 . . . . 73.120000000000005 109.904 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.743 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 27.2 ttpp -53.54 -51.77 61.84 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.239 -0.437 . . . . 72.450000000000003 111.31 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -80.41 -11.22 59.72 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.318 -0.553 . . . . 65.319999999999993 110.45 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -83.49 -27.78 29.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.312 -0.404 . . . . 74.209999999999994 110.012 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.743 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 19.0 ptp -88.9 -33.23 17.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.353 -0.981 . . . . 73.010000000000005 108.353 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.686 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 61.6 mtp -85.56 14.66 5.34 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 115.402 -0.817 . . . . 74.329999999999998 111.144 178.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -87.37 -39.57 15.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.182 0.515 . . . . 74.200000000000003 110.321 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.635 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 39.2 p90 -103.59 -9.89 18.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.098 -0.501 . . . . 73.420000000000002 111.758 -173.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.6 m-30 -56.74 -48.94 76.67 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.864 0.364 . . . . 73.430000000000007 110.902 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.84 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.24 -47.03 72.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.53 0.681 . . . . 74.409999999999997 110.101 176.459 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -82.93 34.49 0.45 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.017 -0.992 . . . . 73.150000000000006 110.975 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.665 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 2.1 mmp_? -107.76 -32.57 7.57 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.982 -0.449 . . . . 75.230000000000004 110.995 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.774 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -107.08 3.61 26.04 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.348 -0.541 . . . . 72.129999999999995 110.027 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.83 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 82.2 tttt -63.96 -54.04 40.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.025 -0.534 . . . . 74.329999999999998 110.748 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -62.6 -24.79 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.906 -0.588 . . . . 65.239999999999995 111.499 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.599 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 64.1 mtm -90.89 -23.0 20.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.022 0.439 . . . . 75.420000000000002 110.456 -179.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.404 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 6.2 tt -73.16 -38.65 66.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.755 -0.832 . . . . 72.239999999999995 108.755 176.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.597 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 26.8 t70 -60.32 -31.88 70.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.321 -0.854 . . . . 72.150000000000006 110.588 178.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.59 -14.29 60.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.602 -0.726 . . . . 73.420000000000002 111.621 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -97.44 -9.96 26.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.224 0.535 . . . . 71.129999999999995 110.641 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.433 ' C ' ' H ' ' A' ' 83' ' ' ASP . 22.5 mmt -75.45 -169.64 1.05 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.891 -0.595 . . . . 74.340000000000003 110.276 174.418 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.558 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 64.17 -11.03 0.13 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.876 1.065 . . . . 74.310000000000002 113.876 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.433 ' H ' ' C ' ' A' ' 81' ' ' MET . 32.0 t70 -53.57 -62.64 1.52 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.735 0.302 . . . . 52.329999999999998 111.457 -178.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -81.99 5.68 18.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.756 0.313 . . . . 72.510000000000005 111.019 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.585 HG21 ' HB2' ' B' ' 259' ' ' GLN . 51.6 mt -97.74 -59.7 3.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.42 -0.354 . . . . 75.140000000000001 111.258 -175.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.4 pt-20 -71.88 -18.49 62.04 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.567 -0.453 . . . . 73.439999999999998 110.884 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -97.37 1.39 49.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.278 -0.419 . . . . 71.439999999999998 110.481 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -63.01 -38.43 91.18 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.658 -0.497 . . . . 73.430000000000007 109.658 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 N--CA 1.465 0.276 0 CA-C-N 115.622 -0.717 . . . . 72.219999999999999 110.432 174.225 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 26.1 p-10 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 120.689 0.28 . . . . 73.25 110.458 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . 0.518 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . 42.3 tt0 -114.2 74.27 0.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.168 0.508 . . . . 54.240000000000002 110.545 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 68.55 19.95 8.53 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.095 -0.957 . . . . 71.120000000000005 109.54 173.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.501 ' HB2' ' CE2' ' B' ' 208' ' ' TYR . . . -151.53 167.04 29.29 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.291 -0.868 . . . . 74.430000000000007 111.325 -170.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.479 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -90.59 45.65 1.28 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.811 -0.631 . . . . 71.340000000000003 111.066 -179.154 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.518 ' CE2' ' HB3' ' B' ' 204' ' ' GLU . 69.3 m-85 -49.07 -49.54 41.05 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.357 -0.383 . . . . 65.150000000000006 111.476 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.44 -34.8 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.142 -0.481 . . . . 70.519999999999996 111.819 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 10.5 mmp_? -68.69 -59.27 3.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.462 -0.335 . . . . 62.25 110.223 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.733 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -61.92 -17.66 57.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.888 -0.597 . . . . 72.329999999999998 111.593 -176.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 212' ' ' THR . . . . . 0.499 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 24.3 m -60.43 -34.4 73.93 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.633 -0.712 . . . . 72.230000000000004 110.921 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.487 ' HB2' HD12 ' A' ' 17' ' ' LEU . 32.2 mt-10 -81.1 -25.42 36.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 63.240000000000002 110.18 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.733 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.7 mm? -66.52 -41.22 89.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.641 -0.708 . . . . 74.530000000000001 110.209 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.406 HG13 ' HB1' ' A' ' 39' ' ' ALA . 93.2 mt -73.99 -18.58 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.898 -0.592 . . . . 72.109999999999999 111.194 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' B' ' 212' ' ' THR . 31.2 mmmt -62.47 -40.53 96.95 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.042 -0.411 . . . . 74.340000000000003 111.043 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.516 ' O ' HD12 ' B' ' 217' ' ' LEU . 2.2 tm? -65.79 -34.78 78.96 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.391 -0.596 . . . . 73.140000000000001 109.391 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.14 93.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.885 -0.598 . . . . 74.420000000000002 110.36 -178.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.558 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 24.4 m-80 -60.84 -35.07 75.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.961 -0.563 . . . . 73.430000000000007 110.678 178.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.08 -28.69 63.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 75.219999999999999 111.663 -179.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -84.22 -22.66 30.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.403 0.621 . . . . 64.430000000000007 110.032 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . 0.472 ' HA ' HG22 ' B' ' 232' ' ' VAL . 3.3 t-20 -75.84 -8.56 57.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.271 -0.877 . . . . 73.400000000000006 109.94 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.558 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 10.9 mm-40 -83.32 1.23 42.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.793 -0.64 . . . . 62.549999999999997 110.653 177.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.448 HD21 HG13 ' B' ' 227' ' ' ILE . 1.0 OUTLIER -89.33 111.62 22.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.356 -0.383 . . . . 73.120000000000005 110.157 -178.306 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.0 t -65.59 -36.69 84.5 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.986 0.736 . . . . 74.439999999999998 112.986 -173.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.69 -9.94 59.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.091 0.404 . . . . 63.520000000000003 112.091 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.539 HG21 ' HB2' ' B' ' 231' ' ' GLU . 7.0 mt -101.15 145.06 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.541 -0.54 . . . . 73.120000000000005 109.541 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.733 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 38.0 mt-30 -78.55 150.45 32.83 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.958 -0.564 . . . . 75.340000000000003 109.726 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -35.92 72.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.912 0.387 . . . . 53.439999999999998 110.519 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.71 -16.5 76.14 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.791 -0.641 . . . . 70.239999999999995 113.355 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.733 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 9.3 mm-40 -76.87 -31.33 56.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 117.477 0.639 . . . . 72.209999999999994 110.103 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . 0.472 HG22 ' HA ' ' B' ' 222' ' ' ASN . 22.0 t -72.05 -31.51 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.699 0.761 . . . . 73.319999999999993 109.762 178.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.14 -29.47 66.4 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.521 -0.763 . . . . 73.349999999999994 109.665 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.39 -33.41 37.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.592 -0.731 . . . . 73.040000000000006 111.424 -177.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 10.5 p -66.53 -36.74 83.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.096 -0.335 . . . . 71.200000000000003 110.096 178.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.569 ' CD1' HD12 ' A' ' 14' ' ' LEU . 3.2 t80 -65.78 -38.06 87.99 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.381 -0.6 . . . . 73.299999999999997 109.381 174.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.774 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.2 tpt -61.4 -54.38 44.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.232 -0.894 . . . . 72.430000000000007 110.639 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.599 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 27.2 t-105 -64.01 -36.58 84.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.517 -0.765 . . . . 71.310000000000002 111.421 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -62.01 -43.46 98.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.658 0.266 . . . . 72.109999999999999 110.744 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.418 HD23 ' HE3' ' A' ' 37' ' ' MET . 56.8 tp -63.01 -37.94 89.2 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.481 -0.327 . . . . 74.209999999999994 110.446 176.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.549 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -57.91 -39.99 79.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.475 -0.33 . . . . 52.450000000000003 111.347 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -75.02 -43.14 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.306 0.574 . . . . 74.420000000000002 110.283 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.413 ' HD2' HG21 ' A' ' 15' ' ' ILE . 14.5 t80 -69.81 -30.25 67.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.497 -0.774 . . . . 71.5 110.895 -175.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -79.87 -38.52 32.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.045 -0.525 . . . . 75.450000000000003 111.082 -175.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.14 -18.52 48.2 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.97 -0.559 . . . . 64.140000000000001 111.834 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -54.79 -34.22 62.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.789 -0.641 . . . . 73.230000000000004 111.227 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.827 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 41.5 m-85 -67.5 -15.08 63.48 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 112.12 0.415 . . . . 75.349999999999994 112.12 -176.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.624 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -55.99 -31.09 58.33 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.596 -0.812 . . . . 64.340000000000003 112.143 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 62.2 p -74.19 -14.23 60.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.722 0.296 . . . . 74.430000000000007 111.455 -177.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 34.0 p -98.21 -5.96 32.24 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.848 0.356 . . . . 64.239999999999995 111.119 -176.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 67.3 m -78.89 -41.97 28.38 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 116.137 -0.483 . . . . 73.409999999999997 111.647 -175.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.61 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 3.0 m-85 -147.06 176.61 9.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.235 0.457 . . . . 73.409999999999997 112.235 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -101.09 -46.6 5.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.36 -0.836 . . . . 75.549999999999997 111.611 -172.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 40.9 p -100.63 151.19 21.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.52 -0.309 . . . . 75.219999999999999 110.287 -177.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -63.29 -36.29 83.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.126 -0.488 . . . . 74.510000000000005 111.075 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.74 -29.36 69.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.027 -0.533 . . . . 73.040000000000006 111.075 -176.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.744 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 25.6 mt-30 -91.25 -45.04 8.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 71.450000000000003 110.159 177.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.486 ' HE2' ' C ' ' B' ' 248' ' ' GLY . 16.8 ttt -60.5 -41.93 95.3 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.952 -0.567 . . . . 73.140000000000001 111.552 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.585 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.6 tt0 -64.48 -40.09 95.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.83 0.348 . . . . 74.129999999999995 111.329 -178.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.54 -4.78 24.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.174 0.512 . . . . 73.420000000000002 110.954 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.744 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 71.9 mmtt -108.35 4.85 24.93 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.059 -0.519 . . . . 74.430000000000007 110.61 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.562 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 2.6 ptpp? -60.18 -49.46 77.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.399 -0.52 . . . . 72.319999999999993 110.225 -177.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.562 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 7.2 tp-100 -86.02 -1.32 57.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.555 0.693 . . . . 72.340000000000003 110.074 -179.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . 0.41 ' HB3' ' O ' ' B' ' 261' ' ' LYS . 4.1 tp10 -79.74 -43.44 22.59 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.821 -0.627 . . . . 74.219999999999999 109.324 173.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.624 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 3.8 ptt? -86.37 -31.62 21.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.941 0.4 . . . . 74.140000000000001 110.204 177.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.597 ' HE3' ' HB2' ' A' ' 78' ' ' ASP . 60.6 mtp -77.31 7.84 4.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.403 -0.362 . . . . 73.150000000000006 110.952 177.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -78.79 -42.6 27.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.095 0.474 . . . . 65.430000000000007 110.067 176.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.9 p90 -107.65 -12.93 15.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 73.319999999999993 111.751 -172.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 -51.88 -51.6 55.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.791 0.329 . . . . 74.319999999999993 111.199 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.84 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.87 -49.04 78.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.365 0.603 . . . . 75.310000000000002 110.228 177.316 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -87.27 42.02 1.01 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.207 -0.906 . . . . 61.539999999999999 110.647 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -104.61 -42.3 5.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.419 -0.355 . . . . 60.43 110.455 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.706 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -93.32 9.65 35.4 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.503 -0.479 . . . . 75.299999999999997 110.769 -175.531 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.509 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 28.9 ttmt -63.93 -48.75 75.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.929 0.395 . . . . 74.230000000000004 110.426 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -67.66 -25.88 65.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.448 0.642 . . . . 75.030000000000001 110.737 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 276' ' ' MET . . . . . 0.628 ' HB3' ' HE3' ' A' ' 38' ' ' TRP . 56.0 mmm -83.45 -28.12 29.01 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.265 -0.88 . . . . 74.019999999999996 109.792 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.686 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 1.9 tt -72.62 -41.74 65.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.353 -0.84 . . . . 74.420000000000002 108.946 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -61.01 -31.43 71.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.504 -0.771 . . . . 74.010000000000005 110.123 176.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -71.94 -7.52 49.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.265 -0.88 . . . . 75.209999999999994 111.848 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -114.35 -8.22 12.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.95 0.405 . . . . 74.430000000000007 110.96 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.554 ' C ' ' H ' ' B' ' 283' ' ' ASP . 39.9 mtt -87.85 -162.77 0.85 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.269 -0.423 . . . . 75.400000000000006 110.248 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.62 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 5.0 mm-40 65.43 -22.9 0.09 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.79 0.836 . . . . 74.430000000000007 112.75 -176.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . 0.554 ' H ' ' C ' ' B' ' 281' ' ' MET . 20.6 t70 -48.03 -63.48 1.06 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.322 0.649 . . . . 74.239999999999995 111.883 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -68.0 -32.15 72.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.029 0.442 . . . . 55.210000000000001 110.813 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.584 HG21 ' HB2' ' A' ' 59' ' ' GLN . 46.0 mt -65.25 -56.96 12.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.666 -0.697 . . . . 75.230000000000004 111.52 -173.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 13.4 pt-20 -65.72 -21.01 66.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.848 0.356 . . . . 74.200000000000003 110.906 -177.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -102.1 9.18 40.47 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 74.329999999999998 112.272 -177.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -58.38 -52.94 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.53 -0.468 . . . . 73.209999999999994 110.325 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 74.450000000000003 110.954 178.246 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.491 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.9 p-10 . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 109.29 -0.633 . . . . 73.519999999999996 109.29 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -63.8 -57.59 9.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.613 -0.721 . . . . 74.120000000000005 110.517 -178.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -136.96 -56.61 0.72 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.987 0.423 . . . . 74.420000000000002 109.998 175.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -68.25 167.1 15.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.78 -0.646 . . . . 75.310000000000002 111.652 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.411 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -79.1 49.56 0.96 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.219 -0.9 . . . . 72.340000000000003 111.845 -178.127 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -53.31 -42.42 66.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 75.510000000000005 110.972 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.4 -9.38 47.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.68 -0.691 . . . . 74.439999999999998 112.222 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.455 ' HE ' ' HA ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -98.54 -62.21 1.27 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.745 -0.465 . . . . 74.209999999999994 109.745 178.598 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.675 ' HA ' HD22 ' A' ' 14' ' ' LEU . . . -55.24 -23.88 24.8 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.743 0.646 . . . . 73.439999999999998 112.743 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.7 t -66.43 -24.92 66.53 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.738 0.304 . . . . 72.400000000000006 110.887 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.561 ' HB2' HD11 ' B' ' 217' ' ' LEU . 31.2 mt-10 -80.75 -31.17 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.481 0.658 . . . . 73.400000000000006 109.528 -177.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.675 HD22 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -67.16 -48.73 67.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.03 -0.986 . . . . 75.019999999999996 110.144 -178.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.438 HG13 ' HB3' ' B' ' 239' ' ' ALA . 77.0 mt -65.82 -29.11 45.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 75.340000000000003 110.53 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -25.88 65.37 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.98 -0.555 . . . . 74.129999999999995 110.681 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.52 HD12 HD13 ' B' ' 214' ' ' LEU . 2.4 tm? -75.42 -45.94 35.76 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.86 -0.792 . . . . 64.239999999999995 108.86 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.438 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -59.87 -37.54 79.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.519 0.676 . . . . 73.209999999999994 109.692 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -56.58 -30.39 63.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.775 -1.102 . . . . 51.140000000000001 110.529 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -78.24 -35.07 48.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.772 . . . . 74.140000000000001 110.992 -176.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -79.2 -23.33 43.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.196 -0.456 . . . . 74.219999999999999 110.999 -176.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -86.89 7.51 26.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.238 0.542 . . . . 75.239999999999995 110.499 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -79.3 8.24 6.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 73.040000000000006 111.184 177.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.766 ' HB3' HG13 ' A' ' 27' ' ' ILE . 3.3 t30 -101.94 111.9 24.33 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.426 -0.583 . . . . 73.129999999999995 109.426 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.6 t -56.03 -33.51 64.99 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.382 -0.826 . . . . 73.540000000000006 112.626 -175.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -95.68 13.79 25.23 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.438 0.533 . . . . 75.140000000000001 112.438 -173.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.766 HG13 ' HB3' ' A' ' 24' ' ' ASN . 5.7 mt -111.78 150.25 14.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.542 -0.54 . . . . 74.420000000000002 109.542 172.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.846 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 42.6 mt-30 -72.47 144.26 48.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.958 -0.564 . . . . 74.25 109.976 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 m -63.66 -26.32 68.61 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.228 -0.656 . . . . 61.240000000000002 109.228 175.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.467 ' HA2' ' OG ' ' A' ' 33' ' ' SER . . . -78.65 -8.03 87.87 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.195 -0.912 . . . . 63.100000000000001 113.122 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.846 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 12.6 mm-40 -78.64 -25.72 45.04 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.437 0.619 . . . . 74.430000000000007 109.859 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.438 HG11 ' O ' ' A' ' 18' ' ' ALA . 16.2 t -93.46 -31.49 4.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.353 -0.84 . . . . 75.530000000000001 110.762 -176.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.467 ' OG ' ' HA2' ' A' ' 30' ' ' GLY . 10.2 p -66.71 -37.15 84.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.245 0.545 . . . . 70.129999999999995 109.844 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.9 65.05 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.474 -0.785 . . . . 73.439999999999998 111.446 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.503 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 20.1 p -70.54 -31.79 68.97 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.905 0.383 . . . . 60.039999999999999 110.187 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.601 ' CD1' HD11 ' B' ' 214' ' ' LEU . 9.9 t80 -68.81 -41.35 78.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.879 -0.6 . . . . 75.329999999999998 109.456 174.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.731 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.1 ttm -64.06 -47.42 80.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.549 -0.75 . . . . 75.319999999999993 111.158 177.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.7 t-105 -61.31 -37.43 83.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.067 0.46 . . . . 75.439999999999998 110.751 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.57 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -68.93 -34.13 74.87 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.277 -0.42 . . . . 71.019999999999996 111.199 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.598 HD22 ' SD ' ' B' ' 237' ' ' MET . 48.8 tp -68.9 -35.94 77.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.017 0.437 . . . . 74.400000000000006 110.222 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.03 -42.87 99.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.869 -0.605 . . . . 73.120000000000005 110.72 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -71.94 -19.98 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 75.450000000000003 111.036 -179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -89.18 -42.13 11.84 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.307 -0.406 . . . . 74.239999999999995 110.462 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -69.71 -23.54 63.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 71.420000000000002 111.568 -179.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.37 61.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.144 0.497 . . . . 73.239999999999995 111.477 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -68.63 -31.46 70.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.025 -0.534 . . . . 71.430000000000007 110.881 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.447 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 91.1 m-85 -79.01 2.37 20.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.187 -0.461 . . . . 73.439999999999998 112.049 -173.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.43 ' C ' ' HE2' ' A' ' 58' ' ' MET . . . -59.03 -34.51 79.48 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.486 -0.864 . . . . 73.129999999999995 112.101 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.481 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 13.7 p -74.36 -14.83 60.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.765 0.317 . . . . 71.519999999999996 111.597 -177.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -88.5 -4.04 58.69 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.734 -0.386 . . . . 72.120000000000005 110.713 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.0 t -84.82 -36.97 21.28 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.371 -0.377 . . . . 74.140000000000001 110.756 -176.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -151.5 178.2 9.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.98 0.419 . . . . 75.409999999999997 111.311 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG3' HG22 ' A' ' 54' ' ' THR . 8.5 pt-20 -99.43 -50.11 4.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.581 -0.736 . . . . 75.109999999999999 110.985 -176.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.401 HG22 ' HG3' ' A' ' 53' ' ' GLU . 63.0 p -92.25 150.52 20.83 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.156 -0.475 . . . . 74.129999999999995 110.323 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.438 ' HE2' ' HB2' ' A' ' 55' ' ' LYS . 11.2 ptmm? -68.09 -27.98 66.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.714 -0.394 . . . . 73.310000000000002 110.142 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.15 -54.84 40.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 73.319999999999993 110.465 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.548 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.4 mt-30 -77.38 -34.43 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.824 -0.625 . . . . 74.109999999999999 110.31 -177.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.481 ' HE2' ' HA ' ' A' ' 49' ' ' SER . 20.4 ttt -63.68 -44.61 93.19 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.467 -0.788 . . . . 72.409999999999997 111.079 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.511 ' O ' ' HD2' ' A' ' 62' ' ' LYS . 35.6 tt0 -68.47 -28.6 67.18 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 73.340000000000003 111.234 -176.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.6 -6.68 51.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.494 -0.321 . . . . 44.530000000000001 111.801 -177.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 11.3 mmmm -112.83 10.06 19.06 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.683 -0.488 . . . . 72.409999999999997 109.683 -176.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.511 ' HD2' ' O ' ' A' ' 59' ' ' GLN . 9.6 ptmt -51.27 -41.16 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.379 -0.828 . . . . 74.340000000000003 111.421 -177.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 63' ' ' GLN . 11.1 tp60 -87.76 -30.39 20.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.512 0.196 . . . . 74.109999999999999 110.622 -175.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.08 -37.17 86.14 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 116.377 -0.374 . . . . 71.030000000000001 111.302 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.433 ' HA ' ' CE2' ' A' ' 68' ' ' TYR . 23.2 ptp -83.27 -31.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.77 -0.826 . . . . 73.150000000000006 108.77 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.648 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 21.3 mtp -86.63 33.86 0.65 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.306 -0.861 . . . . 73.439999999999998 112.456 -176.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -129.13 -46.27 1.23 Allowed 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.165 -0.614 . . . . 74.430000000000007 109.949 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.433 ' CE2' ' HA ' ' A' ' 65' ' ' MET . 16.3 p90 -72.42 -17.07 61.83 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.742 -0.383 . . . . 72.129999999999995 110.028 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.711 ' HA ' ' HD3' ' A' ' 72' ' ' ARG . 6.2 m-30 -58.21 -50.5 73.33 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.766 -0.457 . . . . 74.530000000000001 109.766 174.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.624 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.36 -47.11 79.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.669 0.747 . . . . 74.209999999999994 109.467 174.444 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -80.0 31.42 0.26 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.58 -1.191 . . . . 73.129999999999995 111.437 -176.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.711 ' HD3' ' HA ' ' A' ' 69' ' ' TYR . 4.8 mtp180 -103.19 -29.75 11.11 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.662 -0.649 . . . . 72.319999999999993 111.452 -176.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.891 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -115.95 14.65 16.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.325 -0.55 . . . . 74.239999999999995 111.493 -177.746 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 42.6 tttp -63.34 -50.83 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.457 -0.572 . . . . 74.230000000000004 109.457 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.9 -30.79 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.841 -0.618 . . . . 73.420000000000002 111.272 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.4 mtt -69.46 -41.25 76.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.235 0.54 . . . . 72.329999999999998 109.571 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.698 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.6 tt -68.92 -31.78 70.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.99 -1.005 . . . . 74.409999999999997 109.095 -179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -61.86 -34.4 75.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.112 -0.949 . . . . 73.230000000000004 110.912 177.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.05 -4.2 46.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 65.120000000000005 111.1 -178.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.23 -31.18 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.099 0.476 . . . . 74.400000000000006 109.85 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.562 ' HG3' ' SD ' ' B' ' 266' ' ' MET . 25.0 mmt -68.82 176.32 3.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.457 -0.792 . . . . 74.319999999999993 110.663 174.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.556 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 9.6 mm-40 65.29 -30.6 0.13 Allowed 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.331 1.053 . . . . 73.420000000000002 113.19 -177.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . 0.501 ' H ' ' C ' ' A' ' 81' ' ' MET . 22.7 t70 -57.76 -64.02 1.04 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.9 0.381 . . . . 73.319999999999993 110.851 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -68.15 -14.66 63.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.379 . . . . 72.25 110.953 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.537 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 63.3 mt -81.49 -57.71 4.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 75.219999999999999 111.025 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.5 pt-20 -58.48 -34.68 71.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.931 0.396 . . . . 72.230000000000004 110.428 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.42 ' N ' ' HG3' ' A' ' 86' ' ' GLU . 50.6 m-80 -88.11 -0.55 57.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.049 -0.523 . . . . 74.430000000000007 111.462 -177.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.461 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 83.9 t80 -61.34 -43.51 98.75 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 120.4 -0.52 . . . . 75.430000000000007 109.863 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 74.340000000000003 110.238 176.87 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.545 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.2 p-10 . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 121.13 0.491 . . . . 72.540000000000006 111.114 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -81.39 -90.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.805 -0.634 . . . . 75.030000000000001 111.365 -175.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -102.53 -36.83 8.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.285 0.564 . . . . 63.009999999999998 109.846 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.545 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -97.82 150.75 20.93 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.473 -0.785 . . . . 74.409999999999997 110.74 176.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.503 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -75.85 54.77 0.84 Allowed 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.659 -1.155 . . . . 73.409999999999997 112.121 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -52.8 -43.39 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.414 -0.357 . . . . 74.209999999999994 111.094 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -68.03 -10.77 56.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.824 -0.625 . . . . 75.239999999999995 112.086 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.495 ' HE ' ' HA ' ' B' ' 210' ' ' ARG . 1.1 mmp_? -96.13 -60.83 1.55 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.921 -0.4 . . . . 73.209999999999994 109.921 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.669 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -57.24 -20.6 28.4 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.807 0.669 . . . . 65.409999999999997 112.807 -176.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.26 -24.54 65.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.794 0.33 . . . . 71.230000000000004 111.038 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.431 ' HB2' HD13 ' A' ' 17' ' ' LEU . 41.8 mt-10 -87.34 -24.04 24.41 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.13 0.491 . . . . 75.319999999999993 109.962 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.669 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.8 mm? -68.88 -49.1 61.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.538 -0.755 . . . . 65.530000000000001 110.334 -178.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.57 HG13 ' HB2' ' A' ' 39' ' ' ALA . 65.2 mt -68.86 -25.23 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.01 0.433 . . . . 75.5 110.385 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.9 OUTLIER -59.0 -36.07 74.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.048 -0.524 . . . . 74.109999999999999 110.439 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.561 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.3 tm? -65.89 -43.55 87.95 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.096 -0.705 . . . . 74.030000000000001 109.096 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.09 66.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 75.310000000000002 110.678 178.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 12.6 m120 -62.09 -35.09 77.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.008 -0.542 . . . . 75.329999999999998 110.247 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . 0.45 HE22 ' HD3' ' B' ' 216' ' ' LYS . 2.6 mp0 -74.33 -24.96 59.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.195 -0.457 . . . . 75.019999999999996 111.216 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . 0.42 ' HB2' HG12 ' B' ' 232' ' ' VAL . 62.7 mt-30 -86.85 -27.43 23.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.994 0.426 . . . . 72.450000000000003 110.33 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.17 -1.88 46.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.859 -0.61 . . . . 71.519999999999996 110.744 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.8 mm-40 -69.96 -17.52 63.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.108 0.48 . . . . 74.219999999999999 110.388 176.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.633 HD21 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -79.6 124.53 28.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.965 -0.561 . . . . 73.340000000000003 110.109 176.101 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.7 t -99.86 -17.32 17.69 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.09 -0.505 . . . . 74.540000000000006 110.232 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . 0.633 ' HG2' HD21 ' B' ' 224' ' ' ASN . 2.0 pm0 -80.64 -6.42 58.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 75.540000000000006 110.932 176.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.426 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.2 mt -111.96 153.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.467 -0.568 . . . . 74.030000000000001 109.467 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.19 142.21 49.05 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.064 -0.347 . . . . 75.310000000000002 110.064 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.1 m -62.22 -24.08 67.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.523 0.678 . . . . 75.430000000000007 109.981 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . 0.447 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.32 -32.16 83.28 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.383 -0.826 . . . . 74.409999999999997 112.676 178.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -65.09 -32.54 74.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.889 0.376 . . . . 75.430000000000007 110.673 -177.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . 0.42 HG12 ' HB2' ' B' ' 221' ' ' GLN . 11.8 t -75.09 -29.27 21.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 74.140000000000001 110.657 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 72.3 p -74.63 -24.96 58.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.437 0.637 . . . . 72.219999999999999 109.493 175.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.81 -33.91 34.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.446 -0.797 . . . . 75.519999999999996 110.906 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 5.3 p -67.61 -36.63 81.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 120.898 0.38 . . . . 72.299999999999997 110.071 177.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.573 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 2.1 t80 -68.39 -36.01 78.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 74.230000000000004 109.406 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.891 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.3 tpt -63.31 -56.41 16.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.251 -0.886 . . . . 64.519999999999996 110.527 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.3 t-105 -60.53 -35.61 76.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.206 -0.906 . . . . 72.420000000000002 111.103 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.438 ' HB3' HG13 ' A' ' 15' ' ' ILE . . . -65.99 -43.22 88.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.418 -0.355 . . . . 74.299999999999997 111.338 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.18 -34.81 78.45 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.733 0.301 . . . . 73.420000000000002 110.489 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.9 79.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 74.219999999999999 111.102 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . 0.403 HH21 HD13 ' A' ' 15' ' ' ILE . 28.6 mtm180 -70.45 -27.81 64.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 75.040000000000006 111.125 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . 0.438 ' HD2' HG22 ' A' ' 15' ' ' ILE . 8.8 t80 -80.86 -34.86 33.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 72.299999999999997 110.349 -178.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -75.95 -35.82 59.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.029 -0.532 . . . . 72.129999999999995 110.852 -176.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.37 -22.69 63.59 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.967 -0.561 . . . . 74.219999999999999 111.798 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.5 t90 -55.19 -33.86 63.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.99 -0.55 . . . . 75.319999999999993 111.443 179.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -74.58 -7.46 53.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 75.340000000000003 111.975 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.456 ' C ' ' HE1' ' B' ' 258' ' ' MET . . . -65.14 -34.59 90.08 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.271 -0.966 . . . . 74.310000000000002 111.491 176.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.2 m -71.22 -9.69 58.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.76 0.314 . . . . 70.340000000000003 111.681 -177.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.4 t -119.74 16.77 12.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 74.530000000000001 110.388 178.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.6 t -90.22 -27.45 19.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.054 0.454 . . . . 74.319999999999993 109.941 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -146.06 170.41 16.71 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.222 -0.659 . . . . 73.420000000000002 109.222 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.552 ' HG3' HG21 ' B' ' 254' ' ' THR . 10.1 pt-20 -89.41 -37.38 14.87 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.787 -0.365 . . . . 74.109999999999999 111.557 -175.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.552 HG21 ' HG3' ' B' ' 253' ' ' GLU . 72.7 p -110.94 159.75 17.43 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 123.166 0.292 . . . . 75.150000000000006 110.535 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.606 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 12.0 ptmm? -74.79 -26.14 59.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.847 -0.427 . . . . 72.439999999999998 109.847 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -54.47 -42.7 70.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 72.430000000000007 110.619 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.555 ' O ' ' HG3' ' B' ' 261' ' ' LYS . 15.9 mt-30 -91.48 -37.12 13.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.763 -0.653 . . . . 70.450000000000003 110.394 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.606 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 17.9 ttt -60.56 -40.85 93.14 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.078 -0.51 . . . . 70.140000000000001 111.712 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.472 ' HB2' HG21 ' A' ' 85' ' ' ILE . 31.5 tt0 -72.33 -31.17 65.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.067 -0.515 . . . . 73.310000000000002 111.844 -174.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -79.31 -13.42 59.66 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.266 0.555 . . . . 71.0 110.984 -167.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.612 ' HD3' ' C ' ' B' ' 261' ' ' LYS . 0.0 OUTLIER -126.78 26.37 6.22 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 115.67 -0.695 . . . . 74.530000000000001 112.138 -175.512 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.707 ' HA ' ' HE2' ' B' ' 265' ' ' MET . 0.0 OUTLIER -59.17 -35.0 72.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 109.907 175.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.421 ' N ' ' HG2' ' B' ' 262' ' ' LYS . 12.7 tp60 -73.09 -25.56 60.93 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.329 -0.396 . . . . 74.430000000000007 111.434 -176.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -57.47 -55.16 38.37 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.219 0.533 . . . . 73.329999999999998 110.309 176.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.707 ' HE2' ' HA ' ' B' ' 262' ' ' LYS . 2.2 ptt? -72.33 -34.79 68.32 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.955 -0.566 . . . . 74.219999999999999 109.909 -177.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.698 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 26.5 mtp -79.98 19.36 0.71 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.923 -0.581 . . . . 74.519999999999996 111.639 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.98 -44.06 3.06 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.574 -0.528 . . . . 73.329999999999998 109.574 175.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.682 ' CE2' ' HA ' ' B' ' 265' ' ' MET . 20.7 p90 -91.27 -19.41 23.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.016 -0.538 . . . . 73.530000000000001 111.561 -178.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' B' ' 265' ' ' MET . 1.6 m-30 -52.76 -48.17 66.96 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.825 0.345 . . . . 73.049999999999997 110.763 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.767 ' HE2' ' HA ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -54.05 -47.97 71.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.598 -0.728 . . . . 74.400000000000006 111.217 178.353 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.66 26.88 2.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.376 -0.829 . . . . 72.209999999999994 111.765 -168.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -95.66 -26.86 15.56 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.485 -0.486 . . . . 73.120000000000005 111.626 -178.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.731 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.06 11.1 37.64 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.523 -0.471 . . . . 71.209999999999994 110.45 -178.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.589 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 18.6 ttmt -65.01 -43.35 92.79 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.119 -0.491 . . . . 71.209999999999994 110.403 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.43 -39.47 93.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.651 0.263 . . . . 73.150000000000006 111.418 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.5 mtt -61.31 -46.24 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.453 0.644 . . . . 70.310000000000002 109.727 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.648 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 1.1 tt -67.58 -33.25 74.65 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.784 -1.098 . . . . 74.329999999999998 109.663 -178.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . 0.412 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 19.6 t70 -64.86 -28.38 69.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.253 -0.885 . . . . 74.430000000000007 110.425 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -90.33 -2.39 57.99 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.261 -0.881 . . . . 63.420000000000002 111.092 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -104.91 -23.76 12.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 72.439999999999998 110.507 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.441 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.3 mmt -69.31 179.18 2.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.537 0.684 . . . . 71.209999999999994 111.672 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.718 ' HA ' HD12 ' B' ' 285' ' ' ILE . 30.2 mt-10 68.63 -12.29 0.37 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.326 -1.306 . . . . 74.349999999999994 112.97 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . 0.425 ' H ' ' C ' ' B' ' 281' ' ' MET . 24.5 t70 -55.96 -58.93 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 72.209999999999994 110.395 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -72.65 -16.06 61.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.165 -0.471 . . . . 75.329999999999998 110.885 178.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.718 HD12 ' HA ' ' B' ' 282' ' ' GLU . 60.9 mt -77.54 -57.08 6.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.116 -0.493 . . . . 73.129999999999995 110.551 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.2 pt-20 -67.34 -25.26 65.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 72.540000000000006 110.809 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -94.99 15.75 17.99 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.179 -0.464 . . . . 74.200000000000003 111.519 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -58.12 -50.09 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.198 -0.667 . . . . 75.129999999999995 109.198 173.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.4 t70 . . . . . 0 N--CA 1.466 0.334 0 CA-C-N 115.667 -0.697 . . . . 71.420000000000002 111.33 175.112 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.734 ' ND2' ' HA ' ' A' ' 7' ' ' PHE . 89.1 m-20 . . . . . 0 CA--C 1.519 -0.249 0 CA-C-O 121.116 0.484 . . . . 75.439999999999998 111.208 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -97.31 -80.58 0.44 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.4 -0.963 . . . . 75.329999999999998 108.4 168.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -113.6 -47.63 2.98 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.897 -0.779 . . . . 72.450000000000003 108.897 170.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -82.82 159.49 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.408 -0.815 . . . . 72.519999999999996 111.835 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.734 ' HA ' ' ND2' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -75.82 56.36 0.94 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.87 -1.059 . . . . 65.099999999999994 112.309 179.272 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.451 ' HE1' ' HZ2' ' B' ' 238' ' ' TRP . 58.5 m-85 -56.2 -44.35 79.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.514 -0.312 . . . . 73.420000000000002 111.419 -179.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.61 61.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.339 -0.391 . . . . 73.329999999999998 111.627 -177.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -88.18 -65.23 1.04 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.397 -0.365 . . . . 72.120000000000005 110.099 177.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.652 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -58.64 -21.94 55.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 112.68 0.622 . . . . 72.010000000000005 112.68 -175.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.669 HG21 ' HG2' ' A' ' 13' ' ' GLU . 6.1 t -59.41 -28.91 67.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.136 0.494 . . . . 73.430000000000007 110.814 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.669 ' HG2' HG21 ' A' ' 12' ' ' THR . 5.4 mm-40 -92.31 -26.3 18.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.874 -0.603 . . . . 73.340000000000003 110.171 -173.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.652 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -64.51 -45.03 89.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.298 -0.864 . . . . 63.130000000000003 109.178 173.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.538 HG13 ' HB1' ' B' ' 239' ' ' ALA . 89.4 mt -69.24 -34.76 64.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.689 -0.687 . . . . 74.329999999999998 110.373 175.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -64.22 -30.83 71.87 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.849 -0.614 . . . . 64.109999999999999 111.351 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.577 HD13 HD12 ' B' ' 214' ' ' LEU . 3.1 tm? -65.04 -41.85 94.85 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.946 -0.761 . . . . 73.129999999999995 108.946 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.94 70.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.378 -0.828 . . . . 74.540000000000006 110.865 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -63.47 -26.36 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.817 -0.628 . . . . 71.239999999999995 110.978 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.407 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 2.7 mp0 -85.35 -8.61 58.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.207 -0.451 . . . . 75.430000000000007 111.194 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.419 ' OE1' HD23 ' B' ' 214' ' ' LEU . 80.8 mt-30 -104.68 -29.27 10.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.82 0.343 . . . . 74.150000000000006 110.498 177.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.425 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 2.5 t-20 -83.08 -12.47 57.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.037 0.446 . . . . 73.439999999999998 110.569 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.9 pt20 -73.45 -1.01 16.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.175 0.512 . . . . 72.030000000000001 110.326 175.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.622 ' HB3' HG13 ' A' ' 27' ' ' ILE . 2.0 t30 -82.43 108.02 15.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.832 -0.803 . . . . 55.009999999999998 108.832 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.4 t -62.03 -25.61 67.76 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 113.028 0.751 . . . . 71.329999999999998 113.028 -171.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.3 0.88 55.64 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.986 0.365 . . . . 74.540000000000006 111.986 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.622 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.1 mt -113.31 147.78 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.476 -0.564 . . . . 74.230000000000004 109.476 176.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -88.5 157.95 18.48 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.837 -0.431 . . . . 72.010000000000005 109.837 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.425 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 31.4 m -65.73 -27.54 68.39 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.107 0.48 . . . . 73.439999999999998 110.012 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.19 -29.94 76.4 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.63 -0.714 . . . . 73.510000000000005 112.669 178.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -69.96 -30.98 68.47 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.468 0.651 . . . . 72.109999999999999 109.612 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.7 t -82.1 -32.89 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.189 -0.914 . . . . 65.040000000000006 110.771 -177.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -65.92 -28.77 69.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.315 0.579 . . . . 65.109999999999999 109.803 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.0 -32.44 26.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.608 -0.724 . . . . 65.409999999999997 111.216 -178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.433 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 15.1 p -70.51 -36.79 73.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.971 0.415 . . . . 71.549999999999997 109.968 -178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.705 ' HD1' HD13 ' B' ' 214' ' ' LEU . 17.2 t80 -64.93 -35.29 80.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.402 0.62 . . . . 74.319999999999993 109.713 175.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.711 ' HE2' HD22 ' B' ' 240' ' ' LEU . 13.2 ttm -73.27 -47.44 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.657 -0.701 . . . . 74.319999999999993 111.529 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 14.9 t-105 -60.03 -36.63 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.919 0.39 . . . . 74.310000000000002 110.352 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.518 ' HB3' HG13 ' B' ' 215' ' ' ILE . . . -65.64 -38.09 88.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 73.510000000000005 110.862 177.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.837 HD22 ' HE2' ' B' ' 237' ' ' MET . 41.0 tp -66.35 -38.48 87.71 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 110.012 -0.366 . . . . 74.099999999999994 110.012 178.314 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.472 ' HB3' ' HB2' ' B' ' 273' ' ' TYR . . . -60.74 -28.23 68.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.34 -0.391 . . . . 74.439999999999998 111.155 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -86.12 -45.44 11.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.037 0.446 . . . . 73.329999999999998 110.665 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.445 ' HD2' HG23 ' B' ' 215' ' ' ILE . 24.5 t80 -70.22 -37.16 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.898 -0.592 . . . . 65.400000000000006 111.205 -175.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.7 -18.6 58.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.289 -0.414 . . . . 74.340000000000003 111.184 -174.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.557 ' HB3' HD23 ' B' ' 277' ' ' LEU . . . -78.68 -5.15 52.3 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.109 0.48 . . . . 71.420000000000002 110.968 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -57.41 -39.51 76.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.420000000000002 109.913 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -75.91 -9.08 58.31 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.903 -0.59 . . . . 74.319999999999993 111.38 -176.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.486 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.13 -38.32 92.14 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.624 -0.99 . . . . 55.310000000000002 110.624 172.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.7 m -71.74 -6.81 44.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.494 0.318 . . . . 74.310000000000002 111.581 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.1 t -117.44 10.98 13.75 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.209 0.528 . . . . 74.319999999999993 110.113 178.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.73 -44.24 15.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.954 -0.566 . . . . 61.020000000000003 110.236 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.542 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.1 m-85 -145.29 176.35 9.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.426 -0.352 . . . . 70.209999999999994 111.081 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -97.77 -42.29 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.712 -0.676 . . . . 71.310000000000002 111.636 -173.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 63.8 p -102.57 152.41 21.19 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.746 -0.207 . . . . 71.109999999999999 110.509 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -65.85 -32.19 73.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.083 0.468 . . . . 73.120000000000005 110.17 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -52.62 -51.32 60.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.043 -0.981 . . . . 71.519999999999996 110.606 178.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.609 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 20.9 mt-30 -87.65 -32.92 19.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.525 -0.761 . . . . 72.409999999999997 111.064 -176.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.47 ' HE3' ' O ' ' A' ' 48' ' ' GLY . 18.5 ttt -64.21 -42.43 96.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.894 0.378 . . . . 75.430000000000007 110.786 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.539 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 36.7 tt0 -65.67 -27.7 68.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 75.209999999999994 110.679 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.99 -8.45 57.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.358 -0.383 . . . . 74.310000000000002 110.778 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.609 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 29.4 mmmt -114.87 -6.62 12.62 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.35 -0.386 . . . . 73.230000000000004 111.319 -176.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.882 ' HA ' ' HE1' ' A' ' 65' ' ' MET . 56.5 pttt -65.23 -44.7 87.36 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.614 -0.435 . . . . 74.430000000000007 110.956 -172.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.411 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 9.1 tp60 -74.96 -16.99 60.62 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.921 -0.4 . . . . 73.140000000000001 109.921 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -78.82 -38.59 37.76 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.375 -0.375 . . . . 72.439999999999998 110.765 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.882 ' HE1' ' HA ' ' A' ' 62' ' ' LYS . 18.4 ptp -80.65 -27.92 37.02 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.633 -0.877 . . . . 72.019999999999996 108.633 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.635 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 45.5 mtp -90.45 9.6 28.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.994 -1.003 . . . . 72.310000000000002 111.248 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -81.36 -37.15 28.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.401 -0.592 . . . . 74.329999999999998 109.401 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.504 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 48.3 p90 -106.83 -10.1 16.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.607 -0.724 . . . . 74.120000000000005 111.327 -175.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.425 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 2.3 m-30 -55.55 -51.35 67.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.714 0.292 . . . . 75.510000000000005 110.992 -178.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.94 ' HE3' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -56.83 -41.27 77.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.704 0.764 . . . . 74.329999999999998 110.008 175.854 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -80.71 3.74 21.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.417 -1.265 . . . . 74.409999999999997 112.443 -169.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.674 ' HB2' ' SD ' ' B' ' 237' ' ' MET . 48.0 mtm180 -82.76 -41.53 19.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 121.653 -0.654 . . . . 73.329999999999998 110.621 -173.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.807 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -94.12 9.83 36.21 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.285 0.564 . . . . 64.109999999999999 109.924 -176.08 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.759 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 85.5 tttt -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.222 -0.899 . . . . 75.530000000000001 110.003 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -68.93 -30.26 68.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 75.5 110.844 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.41 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 57.1 mtt -68.26 -38.54 81.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.378 0.609 . . . . 75.5 110.064 176.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.675 ' HB3' ' HE3' ' B' ' 266' ' ' MET . 0.5 OUTLIER -72.14 -44.85 62.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.125 -0.943 . . . . 73.510000000000005 110.63 -176.531 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.63 -41.21 80.92 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.314 0.578 . . . . 65.219999999999999 110.213 -178.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.87 -20.12 65.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.078 -0.965 . . . . 74.219999999999999 111.753 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.667 ' OD1' ' HD2' ' B' ' 242' ' ' ARG . 0.8 OUTLIER -92.83 -30.35 15.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.781 0.324 . . . . 72.340000000000003 110.868 179.721 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.58 ' HE1' HD23 ' A' ' 77' ' ' LEU . 21.6 mmt -61.89 -61.96 2.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.776 -0.647 . . . . 74.340000000000003 111.226 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.578 ' HA ' HD11 ' A' ' 85' ' ' ILE . 7.4 pt-20 -70.22 -13.08 62.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.721 -0.672 . . . . 72.430000000000007 112.771 -171.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.1 -51.96 66.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.374 . . . . 72.239999999999995 110.303 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -64.95 -36.51 84.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.128 0.49 . . . . 73.329999999999998 110.0 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.874 HD13 ' HA ' ' B' ' 259' ' ' GLN . 79.3 mt -63.69 -57.16 12.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.382 -0.826 . . . . 73.129999999999995 112.136 -176.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.8 pt-20 -61.72 -32.48 72.71 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.037 -0.265 . . . . 63.450000000000003 111.084 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -93.2 5.24 52.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.342 -0.39 . . . . 72.510000000000005 111.592 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.524 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 63.7 t80 -57.36 -49.88 74.74 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 121.481 -0.088 . . . . 72.0 111.225 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.425 ' OD2' ' HD3' ' B' ' 255' ' ' LYS . 72.1 m-20 . . . . . 0 CA--C 1.519 -0.228 0 CA-C-O 120.985 0.421 . . . . 73.209999999999994 110.45 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.754 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 94.7 m-20 . . . . . 0 CA--C 1.519 -0.242 0 N-CA-C 110.281 -0.266 . . . . 75.120000000000005 110.281 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . 0.438 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 13.6 tp10 -132.43 -77.37 0.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.092 -0.504 . . . . 75.340000000000003 110.239 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -98.92 -21.74 16.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.402 0.62 . . . . 74.549999999999997 109.769 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.489 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -148.72 168.66 22.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.565 -0.743 . . . . 74.540000000000006 112.043 -174.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.754 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -70.87 53.81 0.16 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.488 -1.233 . . . . 73.239999999999995 112.429 178.295 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.438 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 29.3 m-85 -56.24 -47.4 78.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.611 -0.268 . . . . 73.140000000000001 111.136 -178.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.94 -16.05 63.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 63.0 111.735 -176.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.629 ' HE ' ' HA ' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -88.12 -63.59 1.28 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.44 -0.345 . . . . 74.519999999999996 110.16 177.673 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.576 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -53.67 -29.65 39.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.905 0.705 . . . . 72.120000000000005 112.905 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 212' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 7.1 t -64.68 -25.01 67.76 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.675 0.274 . . . . 74.409999999999997 111.073 -177.132 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -82.3 -24.3 34.73 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.251 0.548 . . . . 73.209999999999994 109.622 -178.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.705 HD13 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -68.9 -42.63 76.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.347 -0.842 . . . . 73.010000000000005 109.279 177.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.518 HG13 ' HB3' ' A' ' 39' ' ' ALA . 87.8 mt -68.91 -28.48 39.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.423 -0.808 . . . . 72.120000000000005 110.255 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.505 ' HD2' ' HA ' ' B' ' 216' ' ' LYS . 28.4 mmmt -57.27 -47.26 81.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.349 -0.387 . . . . 73.349999999999994 111.503 178.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.504 HD13 ' O ' ' B' ' 217' ' ' LEU . 1.9 tm? -61.59 -32.17 72.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.5 -0.556 . . . . 74.120000000000005 109.5 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -68.8 -32.98 73.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.819 -0.628 . . . . 61.420000000000002 110.821 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -66.56 -31.05 71.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.877 0.37 . . . . 71.219999999999999 110.783 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.66 -4.81 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.08 -0.509 . . . . 64.109999999999999 111.175 -178.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -110.17 -17.86 13.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.529 0.68 . . . . 72.439999999999998 109.295 172.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . 0.427 ' ND2' HG23 ' B' ' 229' ' ' THR . 22.1 t-20 -78.96 -21.54 47.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.871 -1.058 . . . . 75.420000000000002 110.196 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.17 12.37 0.74 Allowed 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.671 -0.695 . . . . 73.340000000000003 111.975 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.529 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.0 OUTLIER -98.31 109.35 22.12 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 52.509999999999998 109.72 179.599 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.7 t -65.46 -28.89 69.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.488 0.551 . . . . 65.340000000000003 112.488 -173.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -87.91 4.58 44.23 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.915 0.339 . . . . 73.099999999999994 111.915 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.529 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.1 mt -117.86 161.66 16.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.149 -0.686 . . . . 61.219999999999999 109.149 174.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.716 ' N ' HE21 ' B' ' 228' ' ' GLN . 0.0 OUTLIER -105.29 152.23 23.16 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.477 -0.564 . . . . 74.530000000000001 109.477 178.554 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 229' ' ' THR . . . . . 0.427 HG23 ' ND2' ' B' ' 222' ' ' ASN . 5.0 m -55.83 -28.28 55.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.03 0.443 . . . . 72.150000000000006 110.687 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -64.11 -22.67 67.18 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.705 -0.679 . . . . 75.430000000000007 113.22 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -83.84 -17.13 41.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.232 0.539 . . . . 64.349999999999994 110.018 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 15.2 t -90.2 -39.52 12.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 73.450000000000003 109.854 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 33.5 p -65.8 -34.36 77.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.21 0.529 . . . . 72.450000000000003 109.841 175.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -72.03 -34.33 68.72 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.571 -0.741 . . . . 75.299999999999997 111.325 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.455 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 4.0 p -75.82 -32.64 59.92 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.986 -0.376 . . . . 71.409999999999997 109.986 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.476 ' CD1' HD13 ' A' ' 14' ' ' LEU . 2.9 t80 -64.96 -39.73 93.94 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.001 -0.74 . . . . 74.239999999999995 109.001 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.837 ' HE2' HD22 ' A' ' 40' ' ' LEU . 1.2 ttm -66.65 -48.3 69.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.395 -0.82 . . . . 75.340000000000003 111.226 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.451 ' HZ2' ' HE1' ' A' ' 8' ' ' TYR . 19.2 t-105 -60.62 -44.46 96.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.395 -0.366 . . . . 75.019999999999996 110.758 177.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.538 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -61.95 -36.26 80.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.412 . . . . 75.340000000000003 111.057 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.711 HD22 ' HE2' ' A' ' 37' ' ' MET . 42.8 tp -63.52 -40.56 97.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.378 -0.374 . . . . 72.340000000000003 110.278 177.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.571 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.77 -45.1 94.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.065 0.46 . . . . 72.450000000000003 110.344 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . 0.667 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 11.1 mmm180 -58.87 -41.28 86.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 74.430000000000007 110.755 178.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -75.92 -38.22 57.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 64.040000000000006 111.028 -175.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -69.55 -31.78 70.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.887 0.328 . . . . 73.319999999999993 111.887 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . 0.502 ' HB1' HD22 ' A' ' 77' ' ' LEU . . . -72.32 -17.64 61.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 70.409999999999997 111.266 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -64.64 -23.69 67.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.614 -0.721 . . . . 74.200000000000003 109.68 175.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . 0.439 ' O ' HG23 ' B' ' 250' ' ' THR . 69.1 m-85 -85.47 2.89 42.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.095 -0.502 . . . . 74.540000000000006 111.39 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.485 ' C ' ' HE2' ' B' ' 258' ' ' MET . . . -64.75 -35.87 92.44 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.237 -0.982 . . . . 65.040000000000006 111.445 175.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.0 m -62.33 -24.57 67.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.681 0.277 . . . . 71.540000000000006 111.658 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 250' ' ' THR . . . . . 0.439 HG23 ' O ' ' B' ' 247' ' ' PHE . 14.6 t -98.27 10.7 40.05 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.606 -0.438 . . . . 73.540000000000006 110.738 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 33.7 t -87.93 -54.58 4.16 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.966 -0.383 . . . . 63.119999999999997 109.966 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.627 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 2.0 m-85 -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.165 0.507 . . . . 72.540000000000006 111.736 178.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.53 ' HG3' HG22 ' B' ' 254' ' ' THR . 8.9 pt-20 -95.45 -47.22 6.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.12 -0.946 . . . . 74.329999999999998 111.628 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.53 HG22 ' HG3' ' B' ' 253' ' ' GLU . 65.2 p -102.67 161.85 13.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.572 -0.285 . . . . 71.420000000000002 110.501 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.8 ptmt -72.38 -29.8 64.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.877 -0.329 . . . . 74.409999999999997 110.503 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -61.05 -41.7 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.938 -0.574 . . . . 50.329999999999998 110.574 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.596 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 23.3 mt-30 -86.81 -39.75 15.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.922 -0.581 . . . . 74.519999999999996 110.809 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.485 ' HE2' ' C ' ' B' ' 248' ' ' GLY . 13.3 ttt -63.81 -35.8 81.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.404 -0.362 . . . . 75.030000000000001 111.194 -178.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.874 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.9 tt0 -62.52 -40.85 98.08 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.934 0.397 . . . . 74.230000000000004 111.073 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -71.35 -9.12 57.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.836 -0.62 . . . . 64.140000000000001 111.183 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.627 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 31.5 mmmt -107.99 -3.44 18.79 Favored 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 111.947 0.351 . . . . 74.329999999999998 111.947 -173.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.555 ' HA ' ' HE2' ' B' ' 265' ' ' MET . 50.9 pttt -59.51 -49.73 76.65 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.217 -0.593 . . . . 74.319999999999993 110.401 -177.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . 0.498 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 17.8 tp60 -67.46 -23.19 65.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.873 0.368 . . . . 61.039999999999999 110.568 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -82.45 -34.24 28.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.192 -0.458 . . . . 73.439999999999998 111.535 -178.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.555 ' HE2' ' HA ' ' B' ' 262' ' ' LYS . 21.6 ptp -83.88 -25.34 30.31 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.883 -0.784 . . . . 73.219999999999999 108.883 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.675 ' HE3' ' HB3' ' A' ' 77' ' ' LEU . 56.1 mtp -85.83 -12.33 51.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.096 -0.956 . . . . 74.209999999999994 110.664 177.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -54.02 -41.35 67.92 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.099 -0.5 . . . . 53.210000000000001 111.087 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.558 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 17.9 p90 -105.89 -6.11 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.667 -0.697 . . . . 72.430000000000007 110.601 -175.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.478 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 1.4 m-30 -59.3 -54.06 51.13 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.641 -0.254 . . . . 75.400000000000006 110.477 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.861 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.98 -47.88 61.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.305 0.574 . . . . 71.219999999999999 110.207 174.492 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -86.05 23.68 1.46 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.113 -0.949 . . . . 72.129999999999995 112.272 -169.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.558 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 36.2 mtm180 -95.24 -28.84 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.382 -0.824 . . . . 73.209999999999994 111.576 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.596 ' HB3' ' CG ' ' A' ' 37' ' ' MET . 0.1 OUTLIER -112.2 13.04 20.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.175 0.512 . . . . 71.129999999999995 110.195 -178.689 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . 0.94 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 81.8 tttt -64.34 -51.98 60.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.648 -0.705 . . . . 72.530000000000001 110.843 -176.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.5 -30.75 68.68 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.926 0.393 . . . . 74.409999999999997 110.676 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.0 -39.77 93.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.759 -0.655 . . . . 71.319999999999993 110.13 177.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.635 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 0.5 OUTLIER -67.99 -40.03 83.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.481 -0.782 . . . . 73.120000000000005 110.57 -176.45 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.06 -34.87 78.51 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.025 0.44 . . . . 64.230000000000004 110.68 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.63 65.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 72.239999999999995 110.886 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -91.42 -29.28 17.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 74.439999999999998 110.124 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.584 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.9 mmt -61.54 -60.21 4.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 75.329999999999998 109.78 173.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.675 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 72.8 mm-40 -57.23 -22.6 42.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.595 -0.729 . . . . 71.510000000000005 111.926 -177.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -47.83 -50.37 26.33 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.436 0.46 . . . . 52.450000000000003 110.867 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -100.15 -10.61 21.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.369 -0.378 . . . . 75.200000000000003 111.729 178.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.675 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 68.1 mt -74.25 -55.25 12.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.726 -0.39 . . . . 65.430000000000007 110.503 177.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.649 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.1 pt-20 -66.18 -34.74 78.72 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.678 -0.409 . . . . 75.340000000000003 110.524 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.11 8.37 33.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.357 -0.383 . . . . 61.100000000000001 111.361 -178.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.85 -56.14 24.11 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.064 -0.347 . . . . 75.409999999999997 110.064 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 116.213 -0.449 . . . . 73.329999999999998 111.527 -179.87 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 120.79 0.328 . . . . 73.230000000000004 110.598 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -90.54 -71.84 0.6 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.206 -0.665 . . . . 75.109999999999999 109.206 172.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -129.67 -46.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 62.039999999999999 110.049 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.89 164.45 22.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.937 -0.574 . . . . 72.099999999999994 111.599 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.533 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.4 OUTLIER -80.36 43.17 0.62 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.572 -0.74 . . . . 73.329999999999998 112.009 -175.589 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -44.49 -58.81 2.76 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.103 0.409 . . . . 74.420000000000002 112.103 -173.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.6 -21.64 53.98 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.171 0.804 . . . . 72.439999999999998 113.171 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -75.94 -49.22 18.38 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.338 -0.226 . . . . 72.219999999999999 111.032 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.675 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -71.01 -17.48 62.63 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.729 0.776 . . . . 73.439999999999998 109.933 -174.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.4 m -57.26 -37.41 72.31 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 114.453 -1.249 . . . . 64.230000000000004 111.292 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.518 ' HB2' HD11 ' B' ' 217' ' ' LEU . 27.3 mt-10 -81.27 -21.13 39.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 73.329999999999998 110.276 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -69.1 -41.99 76.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 73.349999999999994 109.402 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.493 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.0 mt -74.07 -23.48 18.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.963 -0.562 . . . . 60.340000000000003 110.238 175.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 21.2 mmmt -58.67 -41.3 85.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 72.219999999999999 111.335 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.501 HD11 HD12 ' B' ' 214' ' ' LEU . 2.6 tm? -66.8 -31.38 71.97 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.266 -0.642 . . . . 74.219999999999999 109.266 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 -33.23 72.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.43 -0.805 . . . . 74.349999999999994 110.231 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.642 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 95.1 m-20 -61.39 -42.41 98.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.652 -0.704 . . . . 65.019999999999996 110.494 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.44 -27.38 67.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.947 -0.569 . . . . 75.140000000000001 111.461 -177.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -82.65 -30.13 29.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.276 0.56 . . . . 70.239999999999995 109.916 176.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.413 ' ND2' HG21 ' A' ' 29' ' ' THR . 29.2 t-20 -73.8 -20.07 60.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.501 -0.772 . . . . 72.129999999999995 110.356 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.642 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 89.7 mt-30 -64.2 -16.48 62.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.103 -0.498 . . . . 74.540000000000006 111.059 179.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.45 HD21 HG13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -71.88 104.64 3.54 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.556 -0.535 . . . . 70.129999999999995 109.556 177.368 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -65.68 -34.53 78.43 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.46 -0.791 . . . . 72.329999999999998 111.912 -174.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -78.7 -5.78 54.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.325 0.491 . . . . 74.019999999999996 112.325 -176.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.45 HG13 HD21 ' A' ' 24' ' ' ASN . 7.2 mt -106.05 152.14 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.057 0.456 . . . . 71.049999999999997 110.222 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -79.35 155.96 28.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.76 -0.655 . . . . 74.340000000000003 109.68 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.413 HG21 ' ND2' ' A' ' 22' ' ' ASN . 8.1 m -69.84 -23.97 63.38 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.116 0.484 . . . . 72.109999999999999 110.431 -177.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.44 -14.62 74.72 Favored Glycine 0 C--N 1.333 0.396 0 CA-C-N 115.762 -0.654 . . . . 73.319999999999993 113.587 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -71.75 -37.92 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.416 0.608 . . . . 74.5 110.482 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 20.4 t -73.32 -43.03 57.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.598 -0.728 . . . . 74.349999999999994 110.695 -176.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.3 p -62.09 -44.11 97.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.085 0.469 . . . . 74.430000000000007 110.841 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.2 -32.92 74.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.812 -0.631 . . . . 71.010000000000005 111.14 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.7 m -65.89 -38.96 90.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.878 -0.416 . . . . 71.519999999999996 109.878 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . 0.702 ' HB3' HD12 ' B' ' 240' ' ' LEU . 1.2 t80 -67.12 -36.8 82.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.871 -0.604 . . . . 74.340000000000003 109.747 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.587 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.0 tpt -59.47 -53.76 54.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.157 -0.929 . . . . 61.219999999999999 110.473 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TRP . . . . . 0.464 ' NE1' ' HD2' ' A' ' 42' ' ' ARG . 18.1 t-105 -67.7 -38.7 84.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.943 -0.571 . . . . 75.439999999999998 111.42 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.505 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -62.4 -39.13 92.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.535 -0.302 . . . . 72.129999999999995 111.675 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.472 HD11 ' HB3' ' B' ' 236' ' ' PHE . 47.0 tp -65.44 -31.29 72.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.849 0.357 . . . . 75.530000000000001 110.574 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.18 90.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.248 -0.433 . . . . 74.450000000000003 110.918 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.464 ' HD2' ' NE1' ' A' ' 38' ' ' TRP . 28.8 mtp180 -68.84 -34.0 74.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 65.340000000000003 110.317 -177.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.445 ' HD2' HG22 ' B' ' 215' ' ' ILE . 6.0 t80 -76.64 -32.84 58.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.81 -0.632 . . . . 74.409999999999997 110.896 -175.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -79.21 -33.59 43.68 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.7 -0.227 . . . . 72.140000000000001 111.439 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.32 -17.93 64.97 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.189 0.518 . . . . 63.409999999999997 110.927 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -57.39 -32.32 66.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.193 -0.912 . . . . 74.319999999999993 111.062 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -85.05 1.68 46.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 111.969 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.57 ' C ' ' HE2' ' A' ' 58' ' ' MET . . . -58.59 -38.06 90.47 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.445 -0.883 . . . . 63.5 111.898 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.0 p -70.23 -17.9 63.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.85 0.357 . . . . 74.349999999999994 111.528 -177.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.2 p -92.44 -7.18 48.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 70.040000000000006 110.772 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -75.63 -35.96 60.35 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.229 -0.441 . . . . 52.350000000000001 111.677 -173.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.73 ' HE2' ' HG2' ' A' ' 61' ' ' LYS . 1.0 OUTLIER -147.27 175.67 10.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.329 0.585 . . . . 73.109999999999999 112.349 -175.8 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.619 ' HG3' HG21 ' A' ' 54' ' ' THR . 16.3 pt-20 -89.24 -37.08 15.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.08 -0.964 . . . . 73.030000000000001 111.546 -174.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.619 HG21 ' HG3' ' A' ' 53' ' ' GLU . 65.4 p -118.78 157.69 27.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 75.319999999999993 110.526 -177.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.468 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 21.2 ptmt -66.53 -29.95 70.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 73.540000000000006 110.503 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.34 -49.99 75.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.872 -0.604 . . . . 74.239999999999995 110.384 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.67 ' O ' ' HD3' ' A' ' 61' ' ' LYS . 21.8 mt-30 -78.08 -35.36 49.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.697 -0.683 . . . . 71.319999999999993 110.411 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.57 ' HE2' ' C ' ' A' ' 48' ' ' GLY . 17.0 ttt -61.94 -41.29 97.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.049 0.452 . . . . 74.540000000000006 110.816 178.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.591 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.1 tt0 -65.47 -45.3 84.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.771 -0.65 . . . . 75.030000000000001 111.848 -176.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.36 -24.54 64.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.0 0.428 . . . . 73.430000000000007 111.355 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.73 ' HG2' ' HE2' ' A' ' 52' ' ' PHE . 3.9 mptp? -93.47 8.47 40.5 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 116.033 -0.531 . . . . 75.030000000000001 111.347 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.565 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 17.6 ptpt -51.7 -48.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.507 -0.553 . . . . 70.120000000000005 109.507 177.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.565 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 12.8 tp60 -72.22 -26.03 61.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.103 -0.498 . . . . 72.209999999999994 110.712 -176.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -81.84 -32.8 31.01 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 74.319999999999993 111.495 -176.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.8 ptp -83.36 -26.4 30.53 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 109.051 -0.722 . . . . 61.32 109.051 178.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.668 ' HE3' ' HB3' ' B' ' 277' ' ' LEU . 79.4 mtp -83.86 -4.68 58.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.16 -0.927 . . . . 73.420000000000002 111.756 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.59 -29.28 64.53 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.781 -0.822 . . . . 74.010000000000005 108.781 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.415 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 28.6 m-85 -99.93 -5.99 27.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.653 -1.158 . . . . 75.400000000000006 111.441 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.506 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 19.1 m-30 -77.3 -54.05 6.94 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.685 -1.228 . . . . 72.310000000000002 107.685 169.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.54 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -60.08 -66.27 0.55 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.308 -0.406 . . . . 72.030000000000001 110.21 171.313 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 10.6 t70 -95.44 82.62 3.7 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.437 0.532 . . . . 72.420000000000002 112.437 -171.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 8.8 mmm180 -153.15 -37.01 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.278 -0.419 . . . . 75.239999999999995 111.53 166.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.79 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -84.74 2.51 41.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 119.804 -0.758 . . . . 72.310000000000002 109.019 178.79 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.868 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 85.1 tttt -60.65 -50.55 73.05 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.039 -0.982 . . . . 73.5 110.079 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -37.19 85.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.255 -0.43 . . . . 75.049999999999997 111.113 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.5 mtt -63.01 -41.44 99.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.416 0.627 . . . . 74.400000000000006 109.919 177.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.565 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.3 tt -67.16 -43.06 83.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.815 -1.084 . . . . 73.439999999999998 109.86 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.619 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 8.5 t70 -58.84 -41.17 86.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.279 -0.873 . . . . 65.129999999999995 110.672 178.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.67 -10.36 59.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.413 -0.812 . . . . 70.239999999999995 111.987 -176.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.46 -3.17 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.783 -0.367 . . . . 73.120000000000005 111.463 -179.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.618 ' HE1' ' HA ' ' B' ' 245' ' ' ALA . 23.8 mtt -88.16 -177.77 5.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.287 0.565 . . . . 73.019999999999996 111.752 177.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.713 ' HG2' HD12 ' A' ' 85' ' ' ILE . 34.1 mt-10 66.77 -3.75 0.87 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.634 -1.166 . . . . 71.030000000000001 112.879 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -56.45 -39.39 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.129 0.49 . . . . 71.310000000000002 110.405 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . 0.421 ' HB2' ' HE2' ' B' ' 258' ' ' MET . 33.0 m-85 -92.71 -16.14 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.971 -0.559 . . . . 74.25 110.514 178.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.713 HD12 ' HG2' ' A' ' 82' ' ' GLU . 62.0 mt -79.1 -55.58 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 72.230000000000004 110.808 -175.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.0 pt-20 -64.64 -31.19 72.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.124 0.488 . . . . 55.539999999999999 110.268 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -89.12 7.72 33.66 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.827 -0.624 . . . . 64.230000000000004 111.382 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -62.24 -40.81 97.39 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.072 -0.344 . . . . 75.540000000000006 110.072 178.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 C--N 1.331 -0.22 0 N-CA-C 109.402 -0.592 . . . . 72.349999999999994 109.402 176.617 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 203' ' ' ASN . . . . . 0.562 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 3.2 p-10 . . . . . 0 N--CA 1.452 -0.362 0 N-CA-C 108.57 -0.9 . . . . 74.340000000000003 108.57 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 204' ' ' GLU . . . . . 0.532 ' H ' ' HD2' ' B' ' 208' ' ' TYR . 38.4 tt0 -85.51 -83.48 0.17 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.848 0.356 . . . . 73.319999999999993 111.092 -178.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -116.18 0.11 12.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.401 0.62 . . . . 73.420000000000002 110.739 -177.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 206' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -143.29 179.9 6.8 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.175 -0.466 . . . . 75.319999999999993 111.629 -174.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 207' ' ' PHE . . . . . 0.414 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.2 OUTLIER -73.51 43.91 0.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.218 -0.901 . . . . 72.010000000000005 112.139 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 208' ' ' TYR . . . . . 0.532 ' HD2' ' H ' ' B' ' 204' ' ' GLU . 59.0 m-85 -60.52 -26.04 66.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.08 0.466 . . . . 75.030000000000001 110.991 -178.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -74.48 -24.04 58.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 72.329999999999998 111.539 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 210' ' ' ARG . . . . . 0.414 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 25.1 mmt180 -89.34 -57.67 2.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.569 -0.287 . . . . 74.340000000000003 111.446 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 211' ' ' ALA . . . . . 0.549 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -52.55 -26.79 14.21 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.575 0.583 . . . . 60.409999999999997 112.575 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 7.3 t -69.58 -20.72 63.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.553 0.216 . . . . 70.109999999999999 111.024 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . 0.439 ' HB2' HD12 ' A' ' 17' ' ' LEU . 38.9 mt-10 -85.45 -30.56 23.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.065 -0.717 . . . . 75.530000000000001 109.065 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 214' ' ' LEU . . . . . 0.549 HD22 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.01 -50.1 67.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.216 -0.902 . . . . 75.310000000000002 109.962 177.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 215' ' ' ILE . . . . . 0.505 HG13 ' HB2' ' A' ' 39' ' ' ALA . 82.3 mt -65.32 -30.98 51.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.864 -0.607 . . . . 75.310000000000002 110.74 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 216' ' ' LYS . . . . . 0.411 ' HD2' ' O ' ' B' ' 216' ' ' LYS . 0.5 OUTLIER -61.51 -29.8 70.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.892 -0.594 . . . . 72.329999999999998 110.799 -176.762 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 217' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.5 tm? -72.01 -41.39 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.493 -0.558 . . . . 73.310000000000002 109.493 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.7 -39.11 79.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.755 -0.657 . . . . 73.239999999999995 111.262 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 219' ' ' ASN . . . . . 0.644 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.1 m-20 -61.89 -34.19 75.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 75.150000000000006 111.31 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -65.64 -34.26 77.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.918 0.389 . . . . 74.540000000000006 111.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -79.67 -26.7 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.139 0.495 . . . . 74.230000000000004 110.406 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -79.27 -9.65 59.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.621 -0.718 . . . . 74.209999999999994 110.417 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 223' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 87.2 mm-40 -73.95 -10.58 59.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.323 -0.399 . . . . 62.439999999999998 110.79 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 224' ' ' ASN . . . . . 0.742 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 3.7 t30 -70.68 112.34 6.84 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.833 -0.803 . . . . 63.009999999999998 108.833 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.7 t -47.85 -38.44 16.12 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 114.461 1.282 . . . . 71.530000000000001 114.461 -170.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -99.06 14.99 27.28 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.369 0.877 . . . . 75.030000000000001 113.369 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 227' ' ' ILE . . . . . 0.742 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 8.1 mm -96.7 154.21 3.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 O-C-N 121.472 -0.767 . . . . 63.5 110.062 177.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 228' ' ' GLN . . . . . 0.758 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 9.2 mt-30 -91.87 138.76 31.29 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.467 -0.938 . . . . 74.019999999999996 108.467 171.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 36.6 m -58.0 -27.63 63.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.151 0.5 . . . . 64.540000000000006 110.26 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -72.38 -11.6 76.22 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.512 -0.767 . . . . 74.219999999999999 113.631 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 231' ' ' GLU . . . . . 0.758 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 32.4 mt-10 -85.61 -27.54 25.39 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 117.886 0.843 . . . . 75.430000000000007 109.489 178.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.3 t -79.03 -39.48 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.356 -0.838 . . . . 70.340000000000003 110.175 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.6 p -61.08 -42.02 97.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.109 -0.496 . . . . 54.030000000000001 110.601 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.06 74.86 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.804 -0.635 . . . . 75.420000000000002 110.989 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 235' ' ' SER . . . . . 0.533 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 34.1 m -66.32 -37.45 85.41 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.867 0.365 . . . . 74.439999999999998 110.122 178.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 236' ' ' PHE . . . . . 0.651 ' CD1' HD12 ' A' ' 14' ' ' LEU . 9.6 t80 -64.6 -37.55 87.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.311 0.577 . . . . 73.340000000000003 109.463 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 237' ' ' MET . . . . . 0.79 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.4 ttm -66.39 -48.57 69.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.519 -0.764 . . . . 74.439999999999998 111.349 177.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 238' ' ' TRP . . . . . 0.469 ' O ' ' HG3' ' B' ' 242' ' ' ARG . 28.0 t-105 -62.14 -41.38 98.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.784 0.326 . . . . 75.430000000000007 110.981 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 239' ' ' ALA . . . . . 0.649 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -63.18 -39.29 94.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.84 0.353 . . . . 71.219999999999999 111.068 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 240' ' ' LEU . . . . . 0.702 HD12 ' HB3' ' A' ' 36' ' ' PHE . 42.5 tp -65.8 -36.12 82.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 73.109999999999999 110.503 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 241' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.1 -40.26 95.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.005 -0.543 . . . . 74.340000000000003 110.958 179.135 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 242' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' B' ' 238' ' ' TRP . 44.5 mtp180 -72.09 -37.27 69.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.221 -0.445 . . . . 71.319999999999993 110.073 -178.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -70.78 -40.93 72.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.803 -0.635 . . . . 71.230000000000004 111.013 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -69.28 -28.12 66.02 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.93 0.344 . . . . 64.420000000000002 111.93 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 245' ' ' ALA . . . . . 0.618 ' HA ' ' HE1' ' A' ' 81' ' ' MET . . . -68.82 -18.65 64.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.022 0.439 . . . . 73.450000000000003 111.324 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.8 t90 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.585 -0.734 . . . . 73.420000000000002 111.13 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -72.73 -5.77 40.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 65.340000000000003 112.457 -171.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 248' ' ' GLY . . . . . 0.536 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -58.88 -27.77 62.42 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.469 -0.872 . . . . 40.25 111.502 175.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 249' ' ' SER . . . . . 0.452 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 27.8 p -67.56 -21.2 65.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.558 -0.321 . . . . 75.140000000000001 111.426 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 26.5 p -91.12 -12.13 36.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.06 0.457 . . . . 74.439999999999998 111.039 -176.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 26.1 t -67.07 -42.53 84.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.659 . . . . 72.530000000000001 111.748 -172.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 252' ' ' PHE . . . . . 0.539 ' HD2' ' HG3' ' B' ' 261' ' ' LYS . 1.3 m-85 -150.61 -178.59 6.64 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.985 0.735 . . . . 74.120000000000005 112.985 -173.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 253' ' ' GLU . . . . . 0.504 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.5 pt-20 -93.13 -53.05 4.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.685 -1.143 . . . . 74.049999999999997 110.753 -176.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 254' ' ' THR . . . . . 0.504 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.0 p -100.84 158.57 15.88 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.086 -0.506 . . . . 73.209999999999994 110.505 -178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -68.36 -31.25 70.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.425 -0.352 . . . . 73.310000000000002 111.306 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.46 -45.51 93.44 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 64.420000000000002 110.673 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 257' ' ' GLN . . . . . 0.53 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 18.4 mt-30 -80.49 -35.69 34.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 65.120000000000005 110.129 -179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 258' ' ' MET . . . . . 0.452 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.4 ttt -63.81 -44.89 91.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.512 -0.767 . . . . 72.049999999999997 111.447 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 259' ' ' GLN . . . . . 0.535 ' HA ' HD11 ' A' ' 85' ' ' ILE . 34.6 tt0 -61.3 -39.46 90.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.045 -0.525 . . . . 74.510000000000005 111.39 -178.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.68 63.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.158 -0.474 . . . . 74.239999999999995 111.328 -177.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 261' ' ' LYS . . . . . 0.539 ' HG3' ' HD2' ' B' ' 252' ' ' PHE . 31.9 mmmt -97.51 -5.82 35.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.204 -0.453 . . . . 72.349999999999994 110.897 -176.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 262' ' ' LYS . . . . . 0.457 ' HA ' ' HE2' ' B' ' 265' ' ' MET . 32.7 ttpt -52.67 -54.18 36.95 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.011 0.434 . . . . 71.299999999999997 110.477 -178.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -68.02 -33.05 73.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.091 -0.504 . . . . 72.209999999999994 110.561 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.21 -40.38 78.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.72 -0.673 . . . . 74.239999999999995 111.763 -176.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 265' ' ' MET . . . . . 0.536 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 21.1 ptp -79.82 -25.61 40.77 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.488 0.661 . . . . 73.049999999999997 109.459 -177.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 266' ' ' MET . . . . . 0.619 ' HE3' ' HB2' ' A' ' 78' ' ' ASP . 44.5 mtp -78.32 -42.62 30.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.168 -0.924 . . . . 63.439999999999998 112.681 -176.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.61 -27.34 69.17 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.065 0.394 . . . . 71.409999999999997 112.065 -162.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 268' ' ' TYR . . . . . 0.581 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 30.2 p90 -94.15 -8.12 40.37 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.277 -0.569 . . . . 74.239999999999995 111.133 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 269' ' ' TYR . . . . . 0.409 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.5 m-30 -62.38 -49.69 74.54 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 110.004 -0.369 . . . . 74.439999999999998 110.004 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 270' ' ' MET . . . . . 0.868 ' HE2' ' HA ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -53.54 -41.19 66.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.749 0.785 . . . . 73.219999999999999 109.427 175.314 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -86.75 8.85 20.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.516 -1.22 . . . . 74.329999999999998 111.66 -172.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 272' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 6.0 mmm-85 -84.09 -42.44 16.09 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 121.588 -0.695 . . . . 74.109999999999999 110.159 -174.245 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 273' ' ' TYR . . . . . 0.587 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.0 OUTLIER -99.61 14.94 28.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.698 -0.683 . . . . 75.239999999999995 110.318 -178.653 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -58.45 -58.67 7.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 75.409999999999997 109.64 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.2 -35.38 80.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.162 -0.927 . . . . 74.120000000000005 110.879 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.8 mtt -62.45 -42.43 99.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.857 -0.61 . . . . 71.540000000000006 110.285 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 277' ' ' LEU . . . . . 0.668 ' HB3' ' HE3' ' A' ' 66' ' ' MET . 1.6 tt -70.73 -38.9 73.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.208 -0.906 . . . . 74.239999999999995 110.088 -176.325 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -61.72 -35.37 77.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 74.530000000000001 110.048 175.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.54 -13.01 60.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.577 -0.738 . . . . 73.439999999999998 111.271 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -99.69 -9.25 23.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.571 0.701 . . . . 64.329999999999998 109.351 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 281' ' ' MET . . . . . 0.418 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.2 mmt -84.14 -170.07 2.9 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.85 -1.068 . . . . 73.519999999999996 109.786 174.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 282' ' ' GLU . . . . . 0.611 ' HA ' HD11 ' B' ' 285' ' ' ILE . 22.8 mt-10 72.09 -31.68 0.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.248 -0.887 . . . . 75.430000000000007 113.243 169.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -54.62 -54.79 36.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 74.340000000000003 110.954 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 284' ' ' TYR . . . . . 0.489 ' HB2' ' HE1' ' A' ' 58' ' ' MET . 75.8 m-85 -68.4 -25.8 65.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.948 -0.569 . . . . 73.129999999999995 110.43 178.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 285' ' ' ILE . . . . . 0.611 HD11 ' HA ' ' B' ' 282' ' ' GLU . 54.6 mt -71.21 -56.24 11.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.18 -0.464 . . . . 60.210000000000001 110.76 -178.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 286' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -65.37 -27.91 68.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.063 0.458 . . . . 74.109999999999999 110.882 -178.001 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -94.53 10.3 35.18 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.431 -0.35 . . . . 72.340000000000003 111.497 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 288' ' ' PHE . . . . . 0.468 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 58.7 t80 -59.78 -48.81 80.2 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.18 -0.304 . . . . 74.409999999999997 110.18 177.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.331 -0.395 . . . . 72.349999999999994 110.936 177.817 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.7 t . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 110.013 -0.366 . . . . 75.25 110.013 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -79.51 -31.1 42.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.358 0.599 . . . . 72.409999999999997 109.691 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -122.05 139.94 53.1 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.436 -0.95 . . . . 65.239999999999995 108.436 174.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -82.3 -81.17 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.519 -0.472 . . . . 73.209999999999994 110.65 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -120.4 -11.47 9.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.134 0.492 . . . . 74.239999999999995 110.977 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -108.68 169.52 8.61 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.94 -0.573 . . . . 74.549999999999997 111.547 -177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.81 41.98 0.76 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.614 -0.721 . . . . 75.310000000000002 111.737 -176.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -50.35 -49.91 52.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.388 -0.369 . . . . 74.439999999999998 111.645 -176.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.11 88.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.921 -0.581 . . . . 74.319999999999993 111.819 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtm105 -72.46 -51.04 21.92 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.961 -0.296 . . . . 74.420000000000002 111.618 -176.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HA ' HD22 ' A' ' 14' ' ' LEU . . . -60.5 -24.72 65.53 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.631 0.729 . . . . 71.400000000000006 110.796 -178.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -28.5 68.18 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.062 -0.972 . . . . 75.299999999999997 111.468 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.406 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.8 mt-10 -74.87 -29.21 60.95 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.37 0.605 . . . . 74.319999999999993 109.47 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.616 HD11 ' CD1' ' B' ' 236' ' ' PHE . 3.4 mm? -61.24 -45.94 92.47 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.872 -1.058 . . . . 73.030000000000001 109.694 177.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.402 HG13 ' HB2' ' B' ' 239' ' ' ALA . 65.1 mt -71.96 -27.06 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.713 -0.676 . . . . 72.430000000000007 110.276 177.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.409 ' HD2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -63.36 -31.94 73.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.063 -0.517 . . . . 75.140000000000001 110.431 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.555 HD11 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -68.34 -40.12 81.68 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.15 -0.685 . . . . 73.140000000000001 109.15 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.77 75.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 72.5 111.054 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.54 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 11.5 m-80 -58.52 -40.78 83.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 74.25 110.785 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.409 HE22 ' HD2' ' A' ' 16' ' ' LYS . 2.9 mp0 -67.12 -34.83 78.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.85 -0.614 . . . . 73.409999999999997 111.655 -178.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -76.93 -28.01 55.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.902 0.382 . . . . 75.219999999999999 110.675 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.452 ' HB2' HG22 ' A' ' 32' ' ' VAL . 2.6 t-20 -83.81 -6.32 59.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 61.409999999999997 110.794 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.54 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 46.2 mt-30 -69.97 -11.2 60.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.388 -0.369 . . . . 75.099999999999994 111.861 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.722 ' HB3' ' CG1' ' A' ' 27' ' ' ILE . 40.6 t30 -80.3 135.53 36.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.819 -0.437 . . . . 73.420000000000002 109.819 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.418 ' H ' HG21 ' A' ' 25' ' ' THR . 2.9 t -70.14 -40.58 74.71 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 113.197 0.814 . . . . 73.319999999999993 113.197 -170.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -87.43 1.33 53.72 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.433 0.531 . . . . 72.420000000000002 112.433 -174.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.722 ' CG1' ' HB3' ' A' ' 24' ' ' ASN . 13.2 mm -86.88 147.78 5.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.178 0.514 . . . . 74.239999999999995 109.658 178.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.746 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 2.2 mp0 -82.65 140.8 32.94 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.838 -0.801 . . . . 74.420000000000002 108.838 174.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.2 m -59.35 -28.18 66.6 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.147 -0.686 . . . . 73.209999999999994 109.147 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.516 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -74.09 -12.48 81.47 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.903 -1.044 . . . . 73.540000000000006 113.399 177.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.746 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 43.5 mt-10 -78.63 -35.56 45.33 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 118.079 0.94 . . . . 74.420000000000002 109.92 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 22' ' ' ASN . 21.7 t -74.22 -40.86 51.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.732 -0.667 . . . . 72.420000000000002 110.605 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 p -61.52 -44.14 97.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.063 0.458 . . . . 64.319999999999993 110.255 176.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.43 -31.03 71.91 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.659 -0.701 . . . . 74.299999999999997 110.982 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 63.4 m -67.89 -42.46 81.17 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.029 -0.36 . . . . 74.530000000000001 110.029 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.588 ' CD1' HD11 ' B' ' 214' ' ' LEU . 4.0 t80 -64.61 -33.72 76.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.698 0.761 . . . . 74.409999999999997 109.093 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.785 ' HE3' ' HB3' ' B' ' 273' ' ' TYR . 8.1 tpt -62.23 -60.08 4.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.646 -1.161 . . . . 75.310000000000002 110.935 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.443 ' CZ2' ' HD3' ' A' ' 42' ' ' ARG . 25.7 t-105 -59.36 -33.89 71.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.354 -0.839 . . . . 73.099999999999994 111.303 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.494 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -64.34 -42.99 95.97 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.232 -0.44 . . . . 55.340000000000003 110.991 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.58 HD23 ' SD ' ' B' ' 237' ' ' MET . 55.3 tp -68.83 -34.09 74.91 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 110.024 -0.361 . . . . 74.540000000000006 110.024 178.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -33.11 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 62.420000000000002 111.107 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.474 ' HG2' ' ND2' ' B' ' 280' ' ' ASN . 28.5 mtm180 -87.27 -45.59 10.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.387 -0.369 . . . . 64.420000000000002 111.061 178.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.541 ' HD2' HG22 ' B' ' 215' ' ' ILE . 18.5 t80 -68.18 -33.2 74.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.132 -0.485 . . . . 73.400000000000006 111.458 -173.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -86.49 -22.96 26.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.726 0.298 . . . . 74.230000000000004 111.6 -173.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.25 -10.4 59.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.45 0.643 . . . . 72.510000000000005 110.656 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -59.74 -24.9 64.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.014 -0.994 . . . . 73.430000000000007 111.57 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -86.65 -0.53 56.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.039 0.385 . . . . 65.340000000000003 112.039 -176.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.408 ' C ' ' HE2' ' A' ' 58' ' ' MET . . . -65.12 -29.68 75.95 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 119.982 -1.104 . . . . 62.399999999999999 110.751 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.6 m -71.57 -5.45 33.41 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.254 -0.473 . . . . 74.340000000000003 111.825 -176.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -119.24 14.84 13.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.982 0.42 . . . . 73.340000000000003 111.15 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.95 -47.76 11.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 75.420000000000002 110.476 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.606 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 12.8 m-85 -142.47 165.07 28.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 116.121 -0.49 . . . . 75.25 110.145 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.435 ' HG2' ' H ' ' A' ' 54' ' ' THR . 1.6 pm0 -82.12 -41.77 20.03 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.136 -0.938 . . . . 74.340000000000003 111.362 -171.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.435 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 65.4 p -100.92 149.16 24.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.99 -0.55 . . . . 75.450000000000003 109.739 178.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.485 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 13.2 pttm -68.07 -25.13 65.2 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.57 -0.53 . . . . 72.409999999999997 109.57 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -60.49 -49.77 76.22 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.536 -0.756 . . . . 73.420000000000002 110.574 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.516 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -81.08 -24.69 37.6 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.291 -0.413 . . . . 74.319999999999993 110.341 -178.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.485 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 11.7 ttt -71.8 -44.47 63.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.604 -0.725 . . . . 74.230000000000004 111.194 178.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.41 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 35.4 tt0 -62.68 -36.32 82.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 74.120000000000005 111.371 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.01 -15.03 63.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.152 0.501 . . . . 73.430000000000007 111.313 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.606 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 32.0 mmmt -99.13 1.58 45.17 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.178 -0.465 . . . . 75.319999999999993 111.054 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 0.2 OUTLIER -52.37 -48.52 65.53 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.457 0.473 . . . . 71.530000000000001 110.469 -176.465 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.592 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 14.3 tp60 -72.3 -28.74 63.28 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.223 -0.444 . . . . 75.219999999999999 110.588 -175.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -78.17 -37.06 46.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.852 -0.613 . . . . 74.349999999999994 111.378 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 21.7 ptp -79.71 -26.12 40.95 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.092 -0.707 . . . . 73.230000000000004 109.092 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.523 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 88.7 mtp -81.23 -13.22 58.75 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.398 -0.819 . . . . 73.209999999999994 111.53 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -65.33 -26.96 68.27 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 122.115 0.96 . . . . 73.430000000000007 108.793 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -102.78 16.0 27.75 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.113 -1.403 . . . . 74.540000000000006 111.564 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.604 ' O ' ' HE2' ' B' ' 237' ' ' MET . 22.7 m-30 -106.83 -45.74 4.12 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.985 -0.746 . . . . 74.420000000000002 108.985 172.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.552 ' HE1' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -65.38 -60.66 2.73 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.983 0.421 . . . . 72.239999999999995 110.876 174.604 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -73.84 -16.6 61.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.34 1.237 . . . . 72.409999999999997 114.34 -168.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -96.92 3.04 52.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 113.641 0.978 . . . . 73.540000000000006 113.641 -158.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.624 ' HB3' ' HE3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 7.42 11.51 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.652 -0.704 . . . . 74.010000000000005 109.203 167.623 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.701 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 2.6 pttm -78.78 -39.13 36.72 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.594 -0.73 . . . . 72.129999999999995 111.41 -172.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.48 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -70.23 -31.18 68.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.101 0.476 . . . . 70.329999999999998 110.04 -179.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.6 mtm -77.04 -27.97 54.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.68 -0.691 . . . . 74.430000000000007 110.038 176.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.742 HD13 ' HE3' ' B' ' 270' ' ' MET . 6.8 tt -70.51 -46.86 62.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 72.239999999999995 109.778 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.525 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -60.34 -32.23 71.05 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.054 -0.521 . . . . 75.129999999999995 110.765 176.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.6 -15.31 62.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.919 -0.582 . . . . 64.409999999999997 111.48 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -104.9 -10.26 17.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.812 0.339 . . . . 75.209999999999994 110.537 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.436 ' O ' HG13 ' A' ' 85' ' ' ILE . 17.0 mmt -68.97 -48.36 63.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 74.150000000000006 110.511 177.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.531 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 24.0 mm-40 -56.54 -30.28 62.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.686 -0.688 . . . . 73.200000000000003 111.743 -177.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -56.03 -25.76 46.04 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.039 0.447 . . . . 74.209999999999994 110.975 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -107.69 -32.25 7.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.17 -0.468 . . . . 74.329999999999998 110.879 177.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.647 HG12 ' HE3' ' B' ' 258' ' ' MET . 62.7 mt -70.61 -63.65 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 111.932 0.345 . . . . 75.549999999999997 111.932 -176.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.704 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 0.9 OUTLIER -76.81 -3.26 37.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.045 0.45 . . . . 73.099999999999994 111.268 -174.525 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -107.98 3.85 24.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.688 -0.687 . . . . 65.109999999999999 110.448 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -52.55 -52.84 52.95 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.293 -0.412 . . . . 74.400000000000006 110.936 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -58.13 -33.52 69.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.118 -0.492 . . . . 71.430000000000007 110.753 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -68.29 -51.82 40.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.167 -0.47 . . . . 74.140000000000001 110.414 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -64.97 -38.78 92.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.104 0.478 . . . . 72.310000000000002 110.598 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -62.99 -24.16 67.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.423 -0.808 . . . . 72.140000000000001 109.63 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -90.66 -11.86 38.54 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.71 -0.677 . . . . 75.049999999999997 111.189 -178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 54.0 p -99.79 -2.32 35.4 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.475 -0.329 . . . . 62.420000000000002 111.463 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 3.3 pt20 -99.88 105.94 17.72 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 122.004 0.907 . . . . 75.329999999999998 111.199 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.313 -1.017 0 CA-C-N 114.552 -1.204 . . . . 73.310000000000002 110.122 177.818 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 121.112 0.482 . . . . 63.210000000000001 110.499 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -90.59 5.09 49.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.966 -0.561 . . . . 71.25 110.161 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 -156.05 145.36 20.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.664 -0.698 . . . . 75.099999999999994 109.439 179.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -81.45 -90.58 0.07 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.899 0.381 . . . . 74.129999999999995 110.894 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -106.11 -26.14 11.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 75.319999999999993 110.679 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -100.23 162.35 13.02 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.117 -0.492 . . . . 72.209999999999994 111.161 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.402 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.2 OUTLIER -75.9 43.83 0.28 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.42 -0.809 . . . . 75.400000000000006 112.602 -176.714 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.402 ' CE2' ' HB1' ' B' ' 206' ' ' ALA . 70.9 m-85 -54.17 -41.64 68.74 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.837 0.351 . . . . 75.230000000000004 111.321 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.7 -19.8 63.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.837 -0.62 . . . . 63.409999999999997 112.035 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.4 HH12 HD13 ' A' ' 27' ' ' ILE . 49.2 mtm180 -92.9 -56.97 2.79 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.943 -0.303 . . . . 75.230000000000004 110.799 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.678 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -51.51 -27.37 10.47 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.539 0.57 . . . . 60.329999999999998 112.539 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.6 t -69.5 -20.95 63.71 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 121.058 -0.257 . . . . 74.019999999999996 111.363 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -81.12 -29.46 34.82 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.254 -0.647 . . . . 73.519999999999996 109.254 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.678 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.0 mm? -63.64 -46.54 85.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.975 -1.011 . . . . 72.030000000000001 108.96 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.541 HG22 ' HD2' ' A' ' 43' ' ' TYR . 74.6 mt -67.59 -32.66 57.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.404 -0.816 . . . . 74.140000000000001 110.253 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 2.1 tmmt? -60.39 -36.86 79.09 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.64 -0.709 . . . . 75.310000000000002 111.167 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.523 HD13 HD23 ' A' ' 14' ' ' LEU . 3.2 tm? -63.27 -41.18 99.0 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.787 -0.82 . . . . 72.430000000000007 108.787 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.11 -28.99 68.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 73.0 110.849 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.499 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 0.9 OUTLIER -64.35 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 73.140000000000001 111.036 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -66.82 -39.95 87.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 72.239999999999995 111.196 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.84 -22.2 53.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.446 0.641 . . . . 75.019999999999996 109.945 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.34 -3.31 52.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.167 -0.924 . . . . 64.319999999999993 110.419 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.487 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 52.0 mt-30 -78.93 -8.18 58.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.421 -0.354 . . . . 52.340000000000003 110.864 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.543 HD21 HG13 ' B' ' 227' ' ' ILE . 1.7 t30 -81.84 105.21 12.78 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.646 -0.501 . . . . 72.329999999999998 109.646 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.6 t -59.43 -32.34 70.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.305 0.854 . . . . 75.340000000000003 113.305 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . 0.485 ' HG2' ' ND2' ' B' ' 224' ' ' ASN . 12.4 pt-20 -79.01 -12.4 60.03 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.795 -0.362 . . . . 74.109999999999999 111.068 -175.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.543 HG13 HD21 ' B' ' 224' ' ' ASN . 10.0 mt -97.82 150.0 4.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.104 0.478 . . . . 73.420000000000002 109.966 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -85.87 150.7 24.34 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.814 -0.63 . . . . 71.430000000000007 109.752 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.3 m -57.53 -23.92 53.08 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.674 -0.694 . . . . 73.409999999999997 110.277 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -70.96 -25.62 75.44 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.348 -0.842 . . . . 55.039999999999999 113.692 -179.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -76.64 -13.58 60.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 117.876 0.838 . . . . 74.319999999999993 110.392 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 12.6 t -90.96 -42.06 13.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.705 -0.68 . . . . 62.109999999999999 109.858 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 25.2 p -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.112 -0.494 . . . . 75.329999999999998 110.642 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.65 -33.1 74.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.124 -0.489 . . . . 60.140000000000001 110.693 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 38.7 m -67.68 -40.76 84.4 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.921 -0.4 . . . . 73.140000000000001 109.921 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.616 ' CD1' HD11 ' A' ' 14' ' ' LEU . 2.9 t80 -63.07 -35.63 80.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.539 0.685 . . . . 75.519999999999996 109.478 176.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.624 ' HE3' ' HB3' ' A' ' 73' ' ' TYR . 8.4 tpt -59.45 -60.74 3.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.796 -1.093 . . . . 75.230000000000004 110.808 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 25.3 t-105 -59.56 -36.26 75.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.228 -0.896 . . . . 74.540000000000006 111.532 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.402 ' HB2' HG13 ' A' ' 15' ' ' ILE . . . -64.41 -44.4 91.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.394 -0.366 . . . . 73.219999999999999 111.411 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.652 HD21 ' SD ' ' A' ' 37' ' ' MET . 43.5 tp -65.69 -33.94 77.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.4 . . . . 75.319999999999993 110.658 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.526 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.81 -43.6 97.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.95 -0.568 . . . . 60.32 110.924 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 68.6 mtm180 -70.95 -36.09 72.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 74.040000000000006 110.988 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -72.77 -39.17 66.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.336 -0.393 . . . . 74.329999999999998 110.725 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -72.69 -32.08 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.395 -0.366 . . . . 70.329999999999998 111.98 -177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -67.45 -14.74 63.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.971 0.415 . . . . 72.230000000000004 111.371 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 80.2 t90 -60.56 -38.68 85.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.052 -0.522 . . . . 64.450000000000003 110.962 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.516 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 62.0 m-85 -68.6 -13.92 62.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.288 0.477 . . . . 74.319999999999993 112.288 -175.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.512 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -61.44 -33.81 86.05 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.419 -0.896 . . . . 63.439999999999998 111.767 177.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 70.1 p -65.92 -23.75 66.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.807 0.336 . . . . 71.099999999999994 111.756 -176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 14.5 t -108.83 22.19 16.24 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.227 0.537 . . . . 75.140000000000001 110.444 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.4 t -87.13 -55.32 3.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.175 -0.466 . . . . 64.209999999999994 110.939 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.606 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -130.03 -179.65 5.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.083 0.468 . . . . 74.540000000000006 111.842 -177.313 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.413 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.2 pt-20 -89.87 -41.85 11.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.238 -0.892 . . . . 75.340000000000003 111.539 -173.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.413 HG23 ' HG3' ' B' ' 253' ' ' GLU . 81.9 p -117.31 151.92 35.97 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 110.026 -0.361 . . . . 75.25 110.026 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.704 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 12.7 ptmm? -65.77 -25.8 67.42 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.373 0.421 . . . . 73.420000000000002 110.441 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -56.19 -54.58 43.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 75.299999999999997 110.217 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.628 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 16.3 mt-30 -79.43 -36.3 39.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.582 -0.735 . . . . 74.420000000000002 110.03 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.647 ' HE3' HG12 ' A' ' 85' ' ' ILE . 12.0 ttt -59.93 -46.79 88.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.488 -0.778 . . . . 62.119999999999997 111.577 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.513 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 33.5 tt0 -65.3 -30.27 71.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.953 0.406 . . . . 72.420000000000002 110.96 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -77.55 -9.94 59.21 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.17 -0.468 . . . . 72.129999999999995 110.897 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.628 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.8 mmmt -104.14 -1.13 27.72 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 116.263 -0.426 . . . . 74.510000000000005 110.693 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.513 ' HG2' ' O ' ' B' ' 259' ' ' GLN . 17.1 ptpt -57.5 -45.51 84.84 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.39 -0.368 . . . . 71.019999999999996 110.963 -174.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.5 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 12.2 tp60 -73.4 -19.56 60.96 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.058 -0.257 . . . . 75.209999999999994 110.924 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -83.26 -33.95 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 74.209999999999994 110.908 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.435 ' HG2' ' O ' ' B' ' 262' ' ' LYS . 22.6 ptp -79.93 -26.99 39.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.962 -1.125 . . . . 72.049999999999997 107.962 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.525 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 73.1 mtp -89.92 23.86 2.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.55 -1.205 . . . . 74.030000000000001 110.168 174.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -104.28 -29.43 10.79 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.13 -1.063 . . . . 65.439999999999998 108.13 167.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.412 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.6 m-85 -98.21 9.24 43.43 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.685 -1.143 . . . . 62.109999999999999 112.039 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -94.71 -68.19 0.81 Allowed 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.543 -1.28 . . . . 74.140000000000001 107.543 166.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.742 ' HE3' HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -51.3 -61.29 2.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.134 -0.939 . . . . 74.510000000000005 110.756 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -85.15 19.4 2.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.288 -0.869 . . . . 70.340000000000003 112.483 -166.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.412 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 17.6 mmm180 -121.72 -30.7 4.11 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 121.346 -0.846 . . . . 72.439999999999998 112.564 -175.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.785 ' HB3' ' HE3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.75 1.37 43.11 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.533 -1.284 . . . . 64.430000000000007 107.533 172.14 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.552 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 73.5 tttt -58.76 -58.26 9.37 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 112.929 -1.941 . . . . 75.530000000000001 111.279 178.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -32.51 74.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.445 . . . . 72.409999999999997 111.284 -176.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 39.1 mtm -78.59 -21.97 47.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.203 0.525 . . . . 64.230000000000004 110.08 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.457 HD23 ' HG2' ' A' ' 66' ' ' MET . 5.6 tt -76.43 -47.14 24.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.665 -0.698 . . . . 71.219999999999999 110.004 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.426 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 36.1 t70 -67.15 -26.21 66.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.208 0.528 . . . . 63.539999999999999 110.416 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.01 66.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.603 -0.726 . . . . 71.439999999999998 110.777 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . 0.474 ' ND2' ' HG2' ' A' ' 42' ' ' ARG . 35.7 m-80 -89.17 -30.04 18.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.305 -0.407 . . . . 74.310000000000002 110.244 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.626 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -56.08 -58.77 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 75.140000000000001 110.184 176.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.543 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 14.9 mm-40 -51.71 -37.33 50.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.612 -0.722 . . . . 75.450000000000003 112.081 -178.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.27 -52.37 65.6 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.255 0.347 . . . . 70.5 110.65 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -70.42 -38.29 74.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.399 -0.364 . . . . 72.319999999999993 110.941 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.626 HG13 ' O ' ' B' ' 281' ' ' MET . 61.3 mt -59.9 -59.61 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 73.409999999999997 111.312 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 5.9 pt-20 -60.0 -29.72 68.66 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.906 0.384 . . . . 65.109999999999999 111.204 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -90.86 9.44 30.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.423 -0.353 . . . . 72.430000000000007 111.602 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.443 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 39.1 t80 -60.49 -45.33 94.16 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.805 -0.443 . . . . 75.319999999999993 109.805 173.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -58.51 -20.61 47.46 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.929 -0.578 . . . . 74.140000000000001 110.616 176.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -89.56 -55.11 3.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.698 -0.683 . . . . 74.109999999999999 110.063 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -61.54 -38.31 86.96 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.335 -0.393 . . . . 73.540000000000006 111.976 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.519 ' NH2' ' HA ' ' B' ' 296' ' ' LYS . 5.1 tpm_? -65.44 -21.66 66.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.358 0.599 . . . . 74.329999999999998 110.378 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -92.14 -29.56 16.43 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.618 -0.719 . . . . 65.219999999999999 110.872 -175.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 24.1 p -83.54 -13.68 53.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.046 -0.525 . . . . 72.049999999999997 111.149 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -119.53 162.79 18.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.289 0.566 . . . . 72.010000000000005 111.217 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . 0.519 ' HA ' ' NH2' ' B' ' 292' ' ' ARG . 98.2 mttt . . . . . 0 C--O 1.25 1.107 0 CA-C-N 115.002 -0.999 . . . . 72.239999999999995 109.39 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.476 0.855 0 CA-C-O 120.902 0.382 . . . . 74.209999999999994 110.745 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -78.54 -39.02 39.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.257 0.551 . . . . 63.030000000000001 110.308 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 6' ' ' ALA . 8.4 m120 -105.34 118.87 37.65 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.682 -0.69 . . . . 72.540000000000006 109.222 173.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -55.07 -73.09 0.06 Allowed 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.341 0.401 . . . . 71.549999999999997 111.402 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -133.22 -17.34 2.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.15 0.5 . . . . 74.209999999999994 110.694 177.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -107.48 163.27 13.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.96 -0.564 . . . . 73.219999999999999 111.674 -175.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.496 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -82.18 47.57 1.15 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.151 -0.931 . . . . 75.219999999999999 110.428 176.059 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -45.32 -52.09 10.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.032 -0.531 . . . . 75.209999999999994 111.492 -175.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.1 -34.93 74.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 73.129999999999995 111.972 -175.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -65.25 -54.05 35.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.374 -0.375 . . . . 75.129999999999995 110.497 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.673 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -74.19 -11.6 60.34 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.823 0.82 . . . . 65.25 110.265 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -70.23 -28.15 65.03 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.522 -1.217 . . . . 74.349999999999994 110.292 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.3 mm-40 -82.66 -27.3 31.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.48 0.657 . . . . 73.519999999999996 109.758 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.673 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -65.23 -49.89 67.94 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.081 -0.963 . . . . 64.530000000000001 109.446 176.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.493 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.1 mt -65.15 -30.17 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.796 -0.638 . . . . 74.129999999999995 110.201 175.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.662 ' HD3' HE22 ' A' ' 20' ' ' GLN . 5.3 tmtt? -57.98 -45.87 86.07 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.477 -0.783 . . . . 75.349999999999994 110.504 -179.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.466 HD11 HD12 ' B' ' 214' ' ' LEU . 1.8 tm? -56.04 -45.33 79.23 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.675 -0.491 . . . . 74.239999999999995 109.675 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.64 -28.43 65.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.688 -0.687 . . . . 71.439999999999998 111.287 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.61 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 23.4 m-80 -69.53 -26.89 64.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 71.219999999999999 111.374 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.662 HE22 ' HD3' ' A' ' 16' ' ' LYS . 2.6 mp0 -76.12 -30.54 58.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.246 0.546 . . . . 74.329999999999998 110.383 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -86.81 -16.98 34.57 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.89 -0.595 . . . . 64.239999999999995 110.007 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -84.57 -2.99 58.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.769 -0.65 . . . . 63.009999999999998 109.549 173.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.61 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 93.6 mt-30 -79.2 -2.16 39.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.807 -0.633 . . . . 74.030000000000001 109.718 173.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.577 HD21 HG13 ' A' ' 27' ' ' ILE . 2.3 t30 -74.84 106.85 6.57 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.1 -1.074 . . . . 71.129999999999995 108.1 172.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.2 t -53.53 -40.6 65.63 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 113.825 1.046 . . . . 73.040000000000006 113.825 -167.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -78.91 -21.01 47.98 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 112.36 0.504 . . . . 74.230000000000004 112.36 -176.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.577 HG13 HD21 ' A' ' 24' ' ' ASN . 11.1 mt -84.87 144.57 9.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.171 0.51 . . . . 75.209999999999994 110.139 -176.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.533 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -86.4 156.39 20.19 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.68 -0.691 . . . . 63.299999999999997 109.183 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.1 m -60.62 -30.55 69.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.292 0.567 . . . . 74.129999999999995 109.785 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.462 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -81.95 1.9 85.25 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.326 -0.852 . . . . 73.540000000000006 113.589 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.533 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 21.6 mm-40 -97.33 -19.46 18.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.85 0.825 . . . . 63.439999999999998 109.733 175.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.6 t -81.46 -25.92 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.739 -0.664 . . . . 72.120000000000005 110.169 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 p -59.9 -32.86 71.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.654 -0.703 . . . . 63.100000000000001 111.153 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.27 -34.3 75.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.187 -0.461 . . . . 72.519999999999996 110.71 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 m -69.26 -37.53 77.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 74.129999999999995 109.896 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.564 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 6.7 t80 -68.95 -35.16 76.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.743 -0.662 . . . . 74.109999999999999 109.644 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.779 ' HE2' HD21 ' B' ' 240' ' ' LEU . 3.9 ttm -70.7 -46.68 62.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.74 -0.664 . . . . 72.340000000000003 111.455 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -60.1 -39.57 86.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.108 0.48 . . . . 74.140000000000001 110.331 176.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.58 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.24 -39.7 93.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.895 -0.593 . . . . 74.120000000000005 111.115 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.76 HD23 ' SD ' ' B' ' 237' ' ' MET . 44.0 tp -65.04 -34.8 79.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.363 . . . . 74.120000000000005 110.475 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.99 -48.4 82.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.485 . . . . 65.340000000000003 110.75 177.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.426 ' HG2' ' OD1' ' B' ' 280' ' ' ASN . 20.7 mtm180 -68.81 -23.4 64.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 72.409999999999997 111.051 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.446 ' CE1' ' HA ' ' B' ' 233' ' ' SER . 15.3 t80 -83.7 -31.35 26.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 72.420000000000002 110.735 -178.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -79.42 -26.01 41.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.786 0.326 . . . . 65.109999999999999 111.179 179.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.477 ' HB1' HD23 ' B' ' 277' ' ' LEU . . . -87.55 13.07 10.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.351 0.596 . . . . 63.030000000000001 110.784 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -76.81 -13.86 59.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.485 -0.779 . . . . 75.540000000000006 110.409 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.15 -86.87 0.34 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.429 -0.582 . . . . 74.420000000000002 109.429 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.508 ' C ' ' HE3' ' A' ' 58' ' ' MET . . . 69.67 -60.43 0.69 Allowed Glycine 0 C--N 1.333 0.361 0 O-C-N 123.357 0.411 . . . . 64.439999999999998 112.915 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.413 ' N ' ' HE3' ' A' ' 58' ' ' MET . 11.4 p -75.47 -1.6 24.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.221 0.534 . . . . 72.109999999999999 110.958 -176.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 p -65.84 -31.87 73.07 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.544 . . . . 73.239999999999995 111.392 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -74.22 -45.79 45.94 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.927 -0.579 . . . . 74.420000000000002 111.486 -178.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.497 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 15.9 m-85 -153.09 167.4 29.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.49 0.662 . . . . 74.219999999999999 112.106 -173.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 54' ' ' THR . 1.8 pm0 -91.18 -51.41 5.33 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.353 -1.294 . . . . 74.400000000000006 111.402 -175.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.546 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 65.6 p -90.14 148.26 23.09 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 116.678 -0.237 . . . . 74.219999999999999 110.514 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.468 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 13.9 ptmm? -66.28 -26.21 67.23 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.337 -0.392 . . . . 72.519999999999996 110.478 -176.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -57.39 -42.81 82.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.766 -0.652 . . . . 75.519999999999996 111.049 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.452 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 11.5 mt-30 -93.92 -35.57 12.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.969 -0.56 . . . . 74.25 110.039 -177.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.508 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 15.6 ttt -62.01 -47.88 82.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.364 -0.835 . . . . 74.510000000000005 111.449 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.81 -30.59 71.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 74.540000000000006 111.05 -176.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.88 -5.35 43.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.113 -0.494 . . . . 75.010000000000005 111.446 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.768 ' HE3' ' HG2' ' A' ' 64' ' ' GLU . 28.9 mmmt -116.04 5.36 13.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.448 -0.342 . . . . 70.150000000000006 110.201 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.627 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 31.1 ttpt -57.58 -54.84 42.3 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.306 -0.406 . . . . 73.310000000000002 110.249 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -68.64 -27.92 66.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.37 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.768 ' HG2' ' HE3' ' A' ' 61' ' ' LYS . 5.5 tp10 -65.23 -45.28 85.3 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 116.033 -0.531 . . . . 74.25 110.857 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.636 ' HA ' ' HE1' ' A' ' 68' ' ' TYR . 20.5 ptp -77.75 -26.28 49.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.402 0.62 . . . . 75.329999999999998 109.375 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.731 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 65.6 mtp -80.94 -29.69 35.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.551 -0.75 . . . . 71.439999999999998 112.563 -177.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -64.22 -40.09 95.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.074 0.464 . . . . 75.329999999999998 110.725 -169.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.669 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 36.4 p90 -88.04 -12.15 45.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.931 -0.577 . . . . 71.239999999999995 110.493 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.425 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 2.3 m-30 -60.55 -44.7 95.83 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.229 -0.188 . . . . 75.340000000000003 110.623 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.668 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.55 -49.68 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.975 0.417 . . . . 75.219999999999999 110.05 173.679 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -85.19 47.91 1.49 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.605 0.717 . . . . 75.510000000000005 110.757 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.676 ' HB2' ' HE1' ' B' ' 237' ' ' MET . 1.9 mmp_? -113.06 -23.07 10.23 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 121.705 -0.622 . . . . 73.510000000000005 111.158 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 1.013 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 9.1 11.86 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.621 -0.432 . . . . 65.109999999999999 110.983 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.81 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 63.0 tttm -64.05 -59.16 4.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.485 -0.325 . . . . 73.439999999999998 110.531 -178.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -55.82 -37.83 69.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 74.239999999999995 111.321 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.8 mtt -61.79 -42.11 98.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.484 0.659 . . . . 73.349999999999994 110.332 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.637 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 2.0 tt -69.18 -36.28 77.16 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.229 -0.896 . . . . 75.439999999999998 109.304 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.412 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 12.1 t70 -61.45 -43.27 99.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.02 -0.991 . . . . 75.129999999999995 110.805 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.06 -14.28 62.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.514 -0.766 . . . . 73.540000000000006 111.814 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -99.55 -4.98 29.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.82 0.343 . . . . 72.239999999999995 111.004 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.418 ' HE1' ' CD2' ' A' ' 77' ' ' LEU . 19.0 mmt -80.73 -178.76 6.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.334 0.588 . . . . 72.409999999999997 111.569 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.69 ' HG2' HD11 ' A' ' 85' ' ' ILE . 3.8 mt-10 67.64 -2.33 1.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.641 -1.163 . . . . 74.409999999999997 114.059 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.96 -53.99 45.17 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.031 0.443 . . . . 55.130000000000003 109.95 177.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.418 ' HB2' ' HE3' ' B' ' 258' ' ' MET . 85.4 m-85 -85.4 -9.52 57.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 63.149999999999999 111.255 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.69 HD11 ' HG2' ' A' ' 82' ' ' GLU . 61.6 mt -79.34 -62.2 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.889 0.376 . . . . 73.310000000000002 110.897 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.606 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -66.8 -24.08 66.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.346 -0.388 . . . . 74.540000000000006 110.72 -176.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.523 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . 47.8 m-80 -107.07 16.69 23.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.057 -0.52 . . . . 71.430000000000007 111.111 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.547 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 63.3 t80 -53.94 -49.41 68.75 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.556 0.206 . . . . 75.5 111.556 -177.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -54.77 -27.86 44.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.067 0.46 . . . . 64.140000000000001 111.273 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -82.44 -55.78 4.28 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.061 -0.518 . . . . 72.109999999999999 110.249 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.523 ' CE2' ' HB2' ' A' ' 87' ' ' ASN . 72.8 m-85 -60.05 -39.82 87.3 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.838 0.351 . . . . 71.409999999999997 111.739 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.491 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 2.4 tmm_? -64.32 -25.53 68.08 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.471 -0.566 . . . . 71.010000000000005 109.471 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -94.08 -33.09 13.5 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.477 -0.783 . . . . 73.420000000000002 111.349 -174.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 39.9 p -99.88 9.81 42.36 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.048 0.388 . . . . 74.430000000000007 112.048 -177.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -64.35 158.86 22.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.001 0.429 . . . . 63.420000000000002 110.697 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.1 mttm . . . . . 0 C--N 1.319 -0.72 0 CA-C-N 115.85 -0.613 . . . . 74.450000000000003 110.578 -172.899 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 C--O 1.231 0.091 0 CA-C-O 121.174 0.511 . . . . 61.520000000000003 110.279 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -105.77 6.82 32.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.837 -0.619 . . . . 73.219999999999999 109.848 177.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.417 ' N ' HD21 ' B' ' 203' ' ' ASN . 0.9 OUTLIER -106.71 107.85 19.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.515 -0.766 . . . . 74.239999999999995 110.247 -178.695 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -96.35 100.28 11.9 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.18 -0.464 . . . . 74.549999999999997 110.794 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.9 25.22 3.9 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.748 0.785 . . . . 74.540000000000006 109.14 172.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -152.75 -176.24 5.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 74.450000000000003 111.904 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -130.16 42.15 3.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 74.299999999999997 110.254 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -52.14 -41.05 62.21 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.642 -0.708 . . . . 74.519999999999996 111.843 -177.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.09 -20.7 64.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 71.040000000000006 111.431 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -85.36 -65.2 1.04 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.287 -0.415 . . . . 71.439999999999998 110.091 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.573 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -52.82 -25.98 13.11 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.432 0.901 . . . . 74.510000000000005 113.432 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.8 t -65.63 -28.04 68.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.632 0.253 . . . . 72.409999999999997 111.318 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.7 -18.71 39.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.221 0.534 . . . . 75.420000000000002 110.251 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -71.37 -46.19 61.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.566 -0.743 . . . . 72.5 109.461 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.58 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.8 mt -67.2 -30.79 50.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.427 0.632 . . . . 72.549999999999997 109.905 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -57.55 -39.96 77.84 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.188 -0.914 . . . . 75.430000000000007 111.084 -177.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.437 HD13 HD21 ' A' ' 14' ' ' LEU . 2.8 tm? -63.66 -42.6 98.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.354 -0.385 . . . . 73.019999999999996 110.052 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.41 -33.2 72.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 55.240000000000002 111.402 -177.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.79 -32.73 73.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.304 -0.407 . . . . 72.209999999999994 111.109 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -74.14 -28.22 61.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 72.439999999999998 111.264 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -85.18 -21.18 29.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.923 0.392 . . . . 74.510000000000005 110.519 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -78.13 -1.97 35.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.469 0.652 . . . . 75.219999999999999 109.854 175.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -79.45 -4.43 51.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.877 -0.601 . . . . 74.030000000000001 109.944 175.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.421 HD21 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -69.93 103.52 2.26 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.955 -0.758 . . . . 72.319999999999993 108.955 175.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.9 t -59.86 -26.51 65.91 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 113.287 0.847 . . . . 73.510000000000005 113.287 -171.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . 0.421 ' HG2' HD21 ' B' ' 224' ' ' ASN . 1.6 pm0 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.226 0.454 . . . . 75.209999999999994 112.226 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.416 HG13 HD21 ' B' ' 224' ' ' ASN . 4.2 mt -115.97 150.47 17.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.395 . . . . 74.150000000000006 110.943 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -88.76 166.35 14.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.094 -0.503 . . . . 74.230000000000004 109.783 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 10.4 m -67.22 -27.01 66.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.301 -0.409 . . . . 74.430000000000007 110.659 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -66.52 -27.44 73.16 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.938 -0.574 . . . . 73.299999999999997 113.322 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -74.4 -29.36 61.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.223 0.535 . . . . 73.340000000000003 109.778 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.8 t -76.29 -26.23 16.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 70.450000000000003 109.695 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 233' ' ' SER . . . . . 0.446 ' HA ' ' CE1' ' A' ' 43' ' ' TYR . 2.7 m -65.57 -24.68 67.15 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.819 -0.628 . . . . 75.420000000000002 109.75 174.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -85.51 -33.06 21.89 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.597 -0.729 . . . . 61.43 111.348 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.493 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 9.2 p -68.77 -34.36 75.44 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 120.7 -0.4 . . . . 72.209999999999994 110.41 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.652 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.3 t80 -67.18 -36.33 81.56 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.14 -0.689 . . . . 71.340000000000003 109.14 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 1.013 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.4 tpt -62.66 -57.5 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.142 -0.935 . . . . 75.239999999999995 110.554 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.496 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 31.1 t-105 -60.23 -35.62 75.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.455 -0.793 . . . . 74.510000000000005 111.643 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.494 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -62.65 -47.11 85.13 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.701 0.286 . . . . 71.400000000000006 110.945 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.779 HD21 ' HE2' ' A' ' 37' ' ' MET . 40.0 tp -62.83 -28.21 69.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 72.120000000000005 110.872 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -66.09 -49.44 67.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 72.239999999999995 110.908 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.6 mtm180 -68.76 -23.7 64.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.401 . . . . 64.420000000000002 110.862 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.493 ' HD2' HG23 ' A' ' 15' ' ' ILE . 13.7 t80 -78.9 -26.41 43.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.238 -0.437 . . . . 74.340000000000003 110.58 -179.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -90.61 -24.75 20.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.854 0.316 . . . . 74.430000000000007 111.854 -178.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . 0.476 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -83.66 2.3 38.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.532 0.682 . . . . 75.420000000000002 110.285 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -76.3 -9.21 58.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.803 -1.09 . . . . 72.099999999999994 109.929 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.543 ' HB3' ' OG1' ' B' ' 250' ' ' THR . 80.2 m-85 -95.94 -89.07 0.26 Allowed 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.912 -0.773 . . . . 75.319999999999993 108.912 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.561 ' C ' ' HE1' ' B' ' 258' ' ' MET . . . 64.63 -66.73 0.07 OUTLIER Glycine 0 C--N 1.334 0.437 0 O-C-N 123.663 0.602 . . . . 61.240000000000002 113.325 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 249' ' ' SER . . . . . 0.495 ' N ' ' HE1' ' B' ' 258' ' ' MET . 3.5 p -75.06 -3.34 31.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.107 0.48 . . . . 74.439999999999998 111.043 -175.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 250' ' ' THR . . . . . 0.543 ' OG1' ' HB3' ' B' ' 247' ' ' PHE . 24.1 p -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.948 -0.569 . . . . 75.299999999999997 111.038 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.2 t -86.4 -39.88 15.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.897 -0.592 . . . . 64.409999999999997 111.236 -177.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.528 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 4.0 m-85 -147.67 179.24 7.84 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.772 0.656 . . . . 75.219999999999999 112.772 -173.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.498 ' HG3' ' N ' ' B' ' 254' ' ' THR . 7.9 pt-20 -89.7 -50.98 5.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.035 -0.984 . . . . 71.530000000000001 111.334 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.53 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 68.9 p -107.33 159.44 16.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.071 -0.513 . . . . 72.219999999999999 111.063 -173.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.547 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 20.2 ptmt -67.28 -32.07 72.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.471 -0.331 . . . . 74.510000000000005 110.814 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . 0.53 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.7 mp0 -57.56 -42.73 83.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.167 0.508 . . . . 74.439999999999998 110.46 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 14.1 mt-30 -89.7 -34.97 16.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.677 -0.692 . . . . 75.109999999999999 110.266 -177.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.561 ' HE1' ' C ' ' B' ' 248' ' ' GLY . 14.8 ttt -63.5 -42.34 98.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.828 -0.624 . . . . 74.349999999999994 110.892 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.54 ' HG3' ' HE3' ' B' ' 262' ' ' LYS . 34.6 tt0 -62.64 -37.3 85.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 71.340000000000003 111.005 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.17 -9.0 50.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 52.420000000000002 111.159 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.528 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 30.9 mmmt -109.21 1.07 20.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.115 -0.493 . . . . 74.439999999999998 111.529 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.54 ' HE3' ' HG3' ' B' ' 259' ' ' GLN . 8.2 ptpp? -58.38 -39.74 80.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.711 0.291 . . . . 71.409999999999997 110.594 -175.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -90.1 -24.48 21.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 110.085 -0.339 . . . . 73.510000000000005 110.085 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . 0.404 ' HB2' ' HA ' ' B' ' 261' ' ' LYS . 45.8 mt-10 -75.17 -33.26 61.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 61.140000000000001 111.802 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.2 ptp -77.87 -30.42 50.82 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.073 -1.084 . . . . 72.109999999999999 108.073 175.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.637 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 45.2 mtp -87.33 16.47 5.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.981 -1.008 . . . . 73.019999999999996 110.703 177.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -91.79 -37.71 12.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.249 0.547 . . . . 74.540000000000006 110.072 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.505 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 13.9 p90 -109.06 -5.91 15.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.879 -0.6 . . . . 74.310000000000002 110.925 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -57.75 -48.01 80.86 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.634 0.254 . . . . 75.409999999999997 110.752 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.81 ' HE2' ' HA ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -57.71 -53.37 58.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.923 -0.581 . . . . 64.140000000000001 110.809 175.443 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.39 65.21 8.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.366 0.603 . . . . 74.420000000000002 111.444 -173.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.577 ' HB2' ' SD ' ' A' ' 37' ' ' MET . 85.2 mtm180 -125.63 -27.83 3.35 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.78 -0.645 . . . . 75.099999999999994 109.522 170.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.745 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -104.1 14.45 30.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.282 -0.417 . . . . 63.219999999999999 110.441 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -63.99 -58.76 5.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 75.25 109.828 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.51 -36.03 79.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 74.340000000000003 111.146 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 61.0 mtt -58.02 -46.77 84.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.316 0.579 . . . . 63.450000000000003 109.663 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.731 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 0.9 OUTLIER -67.02 -37.73 84.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.814 -1.085 . . . . 64.109999999999999 109.729 -177.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.498 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 13.8 t70 -64.06 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.499 -0.773 . . . . 75.120000000000005 110.092 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -72.37 -18.3 61.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.661 -0.7 . . . . 64.019999999999996 111.144 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . 0.426 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m120 -89.64 -20.07 24.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.066 0.46 . . . . 72.239999999999995 109.798 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.499 ' C ' ' H ' ' B' ' 283' ' ' ASP . 24.3 mmt -73.67 -165.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 74.299999999999997 110.172 173.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.588 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 6.5 mm-40 66.48 -34.59 0.21 Allowed 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.339 1.056 . . . . 75.010000000000005 112.989 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . 0.499 ' H ' ' C ' ' B' ' 281' ' ' MET . 18.2 t70 -47.9 -60.07 2.87 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.436 0.694 . . . . 73.450000000000003 112.236 -177.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -80.55 -13.33 59.16 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.213 -0.449 . . . . 75.439999999999998 110.808 -177.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.79 -53.61 13.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.116 -0.493 . . . . 73.319999999999993 110.307 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -63.15 -32.21 73.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.137 -0.483 . . . . 72.340000000000003 110.211 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -90.49 11.96 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.792 -0.64 . . . . 75.310000000000002 111.922 -176.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.411 ' CZ ' ' HA ' ' A' ' 54' ' ' THR . 38.3 t80 -58.18 -43.4 87.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.86 -0.793 . . . . 74.420000000000002 108.86 172.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -54.7 -47.92 73.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.47 -0.786 . . . . 72.030000000000001 110.343 173.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -55.92 -59.29 5.1 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.923 -0.58 . . . . 74.329999999999998 111.006 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -70.49 -36.39 73.8 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.548 0.573 . . . . 74.239999999999995 112.548 -172.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -72.07 -21.16 61.56 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.776 -0.369 . . . . 72.099999999999994 110.206 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -86.36 -40.84 15.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.198 0.523 . . . . 74.25 110.289 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.0 p -98.46 29.17 3.75 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.604 -0.726 . . . . 74.239999999999995 110.135 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -60.41 161.7 7.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.762 -1.108 . . . . 73.040000000000006 112.615 -175.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 67.4 mttm . . . . . 0 C--O 1.248 0.977 0 CA-C-N 114.329 -1.305 . . . . 75.430000000000007 109.276 -178.009 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 110.068 -0.345 . . . . 73.450000000000003 110.068 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -78.98 79.13 5.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.247 0.546 . . . . 73.25 110.351 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.432 ' HA ' ' HD2' ' A' ' 8' ' ' TYR . 4.6 p-10 -151.74 105.35 3.12 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.783 0.801 . . . . 72.340000000000003 109.209 174.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -84.22 -72.25 0.47 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.313 -0.858 . . . . 73.430000000000007 112.212 -169.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -89.46 -15.11 33.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.295 0.569 . . . . 75.329999999999998 110.712 -171.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -139.13 167.11 22.8 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.944 -0.571 . . . . 75.230000000000004 111.615 -174.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.521 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.66 47.35 1.17 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.17 -0.923 . . . . 73.319999999999993 111.398 -179.171 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.432 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 68.7 m-85 -49.66 -42.22 44.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.378 . . . . 74.120000000000005 111.907 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.18 -18.8 64.7 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.194 0.442 . . . . 73.510000000000005 112.194 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -83.62 -53.92 5.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.527 0.203 . . . . 73.510000000000005 111.06 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.742 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -66.74 -17.04 64.66 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.89 0.853 . . . . 45.329999999999998 109.932 -176.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -55.53 -35.93 66.19 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.03 -1.441 . . . . 74.439999999999998 111.535 175.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.643 ' HB2' HD13 ' B' ' 217' ' ' LEU . 25.6 mt-10 -83.68 -24.82 31.13 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.125 0.488 . . . . 74.5 110.126 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.742 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -67.12 -44.55 79.61 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.66 -0.7 . . . . 75.340000000000003 109.9 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 67.5 mt -73.48 -22.98 19.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.811 -0.631 . . . . 75.439999999999998 110.357 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -62.04 -34.98 77.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.889 -0.596 . . . . 70.439999999999998 110.622 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.54 HD11 HD12 ' B' ' 214' ' ' LEU . 2.5 tm? -72.71 -39.72 66.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.476 -0.564 . . . . 73.329999999999998 109.476 176.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.86 95.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.222 0.534 . . . . 75.200000000000003 110.23 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.462 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 88.7 m-20 -65.26 -23.09 66.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.869 -0.605 . . . . 73.140000000000001 110.908 177.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -74.1 -35.8 64.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.102 0.477 . . . . 63.030000000000001 110.149 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -81.23 -23.57 37.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.267 0.556 . . . . 72.219999999999999 110.137 178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.63 9.37 7.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.495 0.664 . . . . 73.129999999999995 110.201 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 26.5 mt-30 -83.81 -5.99 59.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.944 -0.571 . . . . 74.319999999999993 110.34 175.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.494 HD21 HG13 ' A' ' 27' ' ' ILE . 1.1 t30 -78.36 109.81 12.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.762 . . . . 72.129999999999995 108.941 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.7 t -65.35 -30.2 71.02 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.916 0.71 . . . . 72.510000000000005 112.916 -170.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -86.12 -11.73 51.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.761 0.652 . . . . 72.040000000000006 112.761 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.494 HG13 HD21 ' A' ' 24' ' ' ASN . 11.0 mt -96.05 144.97 9.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.38 0.61 . . . . 70.420000000000002 110.401 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.478 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -79.7 153.64 29.15 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.272 -0.876 . . . . 75.450000000000003 109.703 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.4 m -62.63 -20.88 65.22 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.965 -0.561 . . . . 65.239999999999995 111.212 -177.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.72 -27.11 72.93 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.903 -0.59 . . . . 63.030000000000001 113.73 -177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.478 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 12.0 mm-40 -75.35 -18.96 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.525 0.663 . . . . 74.439999999999998 110.262 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -86.46 -43.35 16.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.66 -0.7 . . . . 65.0 110.249 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 10.7 p -61.59 -39.26 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.111 -0.495 . . . . 71.340000000000003 110.519 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.67 -33.06 75.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.912 -0.585 . . . . 71.239999999999995 111.11 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.3 m -69.49 -35.77 75.88 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 72.430000000000007 110.059 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.503 ' CD1' HD13 ' B' ' 214' ' ' LEU . 8.1 t80 -67.9 -34.65 77.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.32 0.581 . . . . 74.230000000000004 109.509 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.781 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 13.0 ttm -67.0 -51.24 57.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.465 -0.789 . . . . 74.5 111.54 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 30.1 t-105 -60.65 -37.1 80.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.851 0.357 . . . . 73.230000000000004 110.584 178.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.483 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -65.56 -37.35 86.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 74.510000000000005 111.278 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.829 HD21 ' HE3' ' B' ' 237' ' ' MET . 47.3 tp -70.01 -32.51 70.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.05 0.452 . . . . 73.519999999999996 110.22 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.513 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.45 -42.05 98.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.663 -0.699 . . . . 73.150000000000006 110.845 178.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 42' ' ' ARG . 39.5 mtp180 -69.94 -37.31 75.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.096 0.474 . . . . 75.450000000000003 110.558 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -74.54 -34.81 63.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.789 -0.641 . . . . 72.519999999999996 111.405 -173.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.7 m-20 -74.61 -28.82 61.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.644 0.259 . . . . 73.450000000000003 111.495 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.6 -19.25 63.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.554 . . . . 75.340000000000003 111.055 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -61.9 -27.88 69.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.128 -0.942 . . . . 73.25 110.738 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.498 ' O ' HG22 ' A' ' 50' ' ' THR . 60.0 m-85 -90.41 10.36 25.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.367 -0.379 . . . . 70.319999999999993 111.718 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.488 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.41 -27.16 73.5 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.416 -0.897 . . . . 71.219999999999999 111.423 176.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.1 p -67.57 -27.97 67.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 72.430000000000007 111.313 -177.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.3 t -90.89 12.83 18.25 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.152 0.501 . . . . 71.340000000000003 110.729 -176.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.1 t -78.99 -65.64 0.97 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.248 -0.433 . . . . 65.099999999999994 111.534 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.713 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 5.8 m-85 -133.02 -176.05 3.99 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.559 0.578 . . . . 71.329999999999998 112.559 -172.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.484 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.1 pt-20 -92.62 -48.69 6.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.065 -0.97 . . . . 72.409999999999997 111.415 -172.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.484 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.3 p -105.25 156.59 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.244 -0.435 . . . . 63.140000000000001 110.065 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.494 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.8 ptmm? -70.52 -25.28 63.05 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.837 -0.345 . . . . 75.25 110.882 -175.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -72.05 -42.21 66.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.084 -0.246 . . . . 71.019999999999996 110.917 -178.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.752 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.6 mt-30 -74.15 -45.15 50.53 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 73.319999999999993 109.637 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.497 ' HE1' HG12 ' B' ' 285' ' ' ILE . 17.2 ttt -57.88 -40.68 80.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 72.120000000000005 111.684 -179.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.539 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.5 tt0 -63.53 -36.59 84.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.95 0.405 . . . . 74.420000000000002 111.14 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.77 9.37 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.127 -0.488 . . . . 74.129999999999995 111.12 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.752 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 71.5 mmtt -115.21 -1.99 12.82 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-N 116.223 -0.444 . . . . 74.430000000000007 110.241 -177.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 14.2 ptmt -54.38 -56.5 18.01 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.431 -0.804 . . . . 62.240000000000002 110.393 -178.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.467 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.0 tp60 -70.25 -23.17 62.85 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.775 -0.193 . . . . 73.209999999999994 110.627 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -71.17 -41.48 70.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.44 -0.345 . . . . 71.230000000000004 110.612 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.506 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 20.2 ptp -81.96 -25.44 34.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.487 0.661 . . . . 74.129999999999995 109.309 -179.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.685 ' HE3' ' HB3' ' B' ' 277' ' ' LEU . 69.3 mtp -82.03 -25.25 34.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.426 -0.806 . . . . 75.310000000000002 111.785 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.442 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 23.9 t70 -64.23 -33.09 75.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.965 0.412 . . . . 74.329999999999998 110.582 -169.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -98.01 -14.28 20.64 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.021 -0.536 . . . . 74.400000000000006 110.548 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.446 ' HB2' ' HA ' ' A' ' 66' ' ' MET . 1.0 OUTLIER -57.66 -53.3 59.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 110.08 -0.341 . . . . 65.530000000000001 110.08 174.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.774 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -46.98 -58.53 3.87 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.615 -0.72 . . . . 73.430000000000007 110.879 174.877 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.588 ' OD1' ' HG2' ' B' ' 270' ' ' MET . 5.7 t0 -91.96 28.44 1.84 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.867 -0.606 . . . . 73.319999999999993 111.605 -169.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.427 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 4.6 mtp180 -84.45 -42.39 15.67 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.043 0.449 . . . . 75.319999999999993 110.555 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.722 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.0 OUTLIER -87.78 19.58 3.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.258 0.551 . . . . 75.439999999999998 109.686 -178.445 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.577 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 25.2 tttp -57.11 -66.0 0.53 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.039 -0.982 . . . . 75.430000000000007 110.732 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -64.41 -27.23 68.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 74.239999999999995 110.949 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.4 mtt -66.3 -38.02 86.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.484 0.659 . . . . 74.319999999999993 110.067 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.563 HD21 ' HG2' ' B' ' 266' ' ' MET . 5.4 tt -76.83 -37.37 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.246 -0.888 . . . . 73.209999999999994 109.811 -178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.785 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 13.2 t70 -59.55 -41.19 89.56 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.962 -0.563 . . . . 74.409999999999997 110.421 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.24 -5.63 33.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.287 -0.87 . . . . 71.519999999999996 111.83 -177.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -105.67 -4.44 21.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.954 -0.298 . . . . 75.109999999999999 111.205 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.546 ' HE3' ' CD2' ' A' ' 77' ' ' LEU . 51.7 mtt -95.86 -172.87 2.69 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.842 0.353 . . . . 74.120000000000005 110.839 175.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.665 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 36.3 mt-10 67.12 -6.5 0.58 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.021 0.928 . . . . 74.329999999999998 113.466 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.56 -54.91 38.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.74 0.305 . . . . 63.299999999999997 110.783 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -9.12 49.03 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 120.959 0.409 . . . . 72.409999999999997 110.179 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.665 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -70.43 -57.03 8.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.869 0.366 . . . . 72.510000000000005 110.077 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -68.45 -17.95 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 73.439999999999998 110.733 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -109.32 14.56 23.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 72.310000000000002 111.487 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -58.68 -51.82 68.32 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.73 0.3 . . . . 74.510000000000005 110.296 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -61.75 -36.48 81.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.097 -0.501 . . . . 73.329999999999998 110.273 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -60.24 -56.37 22.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.708 -0.678 . . . . 72.040000000000006 110.514 177.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -62.61 -47.82 82.09 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.441 -0.345 . . . . 73.129999999999995 111.207 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 92' ' ' ARG . 0.1 OUTLIER -60.2 -20.87 60.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.896 -0.593 . . . . 74.310000000000002 110.948 -178.136 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -88.25 -31.12 19.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.107 -0.497 . . . . 64.5 110.844 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 24.9 p -82.62 -26.1 32.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.166 -0.47 . . . . 75.109999999999999 111.376 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -88.95 156.75 18.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.879 0.371 . . . . 73.129999999999995 110.231 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.43 ' HD2' ' N ' ' A' ' 96' ' ' LYS . 6.2 mptt . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 116.129 -0.487 . . . . 72.319999999999993 110.434 -174.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.232 0.138 0 CA-C-O 121.205 0.526 . . . . 73.319999999999993 110.641 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -154.8 103.32 2.42 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.719 -0.673 . . . . 72.530000000000001 109.779 178.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -169.68 148.49 3.66 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.71 -0.478 . . . . 74.120000000000005 109.71 -178.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -78.34 -81.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.57 -0.286 . . . . 75.120000000000005 110.479 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -112.23 -47.06 3.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.896 0.379 . . . . 73.049999999999997 110.623 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -80.26 155.84 27.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.031 0.443 . . . . 75.409999999999997 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.11 51.93 0.7 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.379 -0.828 . . . . 73.519999999999996 112.602 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -56.99 -32.96 66.63 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.976 0.362 . . . . 71.319999999999993 111.976 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -81.1 -7.72 59.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.888 0.329 . . . . 75.010000000000005 111.888 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -94.1 -62.5 1.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.371 -0.233 . . . . 75.319999999999993 110.371 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.677 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.75 -26.34 13.86 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.844 0.683 . . . . 60.130000000000003 112.844 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.01 -18.5 65.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.187 -0.205 . . . . 75.329999999999998 111.534 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.51 -25.61 22.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.296 0.569 . . . . 72.340000000000003 109.573 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.677 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.64 -47.32 69.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 73.209999999999994 109.475 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.483 HG13 ' HB2' ' A' ' 39' ' ' ALA . 71.1 mt -66.56 -29.96 48.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.47 -0.786 . . . . 71.510000000000005 110.667 178.154 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -59.14 -36.51 75.36 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.925 -0.58 . . . . 74.099999999999994 110.758 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.643 HD13 ' HB2' ' A' ' 13' ' ' GLU . 2.5 tm? -68.65 -43.75 75.59 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.432 -0.581 . . . . 70.340000000000003 109.432 178.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.2 -40.9 91.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 74.409999999999997 110.613 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.561 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 84.8 m-20 -60.36 -30.85 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 71.319999999999993 111.199 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -30.05 62.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.338 . . . . 73.010000000000005 111.18 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -84.26 -24.33 29.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.584 0.707 . . . . 73.549999999999997 109.804 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.63 -9.47 58.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.881 -1.054 . . . . 72.409999999999997 110.127 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 25.4 mt-30 -76.99 -6.96 54.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.729 -0.669 . . . . 72.329999999999998 111.252 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.578 HD21 HG13 ' B' ' 227' ' ' ILE . 1.6 t30 -72.77 111.86 8.29 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.603 -0.517 . . . . 74.040000000000006 109.603 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 1.8 t -61.78 -35.51 78.36 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.142 0.793 . . . . 72.450000000000003 113.142 -171.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.57 -1.22 57.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.589 0.589 . . . . 73.219999999999999 112.589 -176.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.578 HG13 HD21 ' B' ' 224' ' ' ASN . 7.0 mt -107.69 153.19 9.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 C-N-CA 120.621 -0.432 . . . . 72.439999999999998 110.125 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.65 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 10.4 pt20 -91.99 159.04 15.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.592 -0.521 . . . . 75.25 109.592 177.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 1.1 m -59.67 -26.56 65.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.253 -0.43 . . . . 75.109999999999999 111.141 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -65.84 -26.36 72.15 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.629 -0.714 . . . . 63.25 113.695 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.65 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 5.7 mm-40 -78.8 -24.53 44.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.387 0.593 . . . . 72.420000000000002 109.615 -178.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 26.3 t -82.24 -41.84 18.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.44 -0.8 . . . . 63.43 110.092 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 13.3 p -62.3 -37.35 85.23 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.112 -0.494 . . . . 72.329999999999998 110.121 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.04 76.63 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.889 -0.596 . . . . 74.450000000000003 110.882 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.521 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 42.3 m -68.41 -35.65 77.97 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.855 0.359 . . . . 73.099999999999994 110.045 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.556 ' CD1' HD13 ' A' ' 14' ' ' LEU . 2.7 t80 -67.55 -38.01 83.51 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.294 -0.632 . . . . 75.040000000000006 109.294 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.829 ' HE3' HD21 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -62.13 -53.05 60.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.097 -0.956 . . . . 74.209999999999994 110.948 176.919 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -61.81 -38.67 89.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.125 -0.489 . . . . 74.109999999999999 111.114 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.634 ' HB3' ' HB1' ' A' ' 11' ' ' ALA . . . -64.37 -41.34 96.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.376 -0.374 . . . . 72.310000000000002 111.423 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.98 -34.39 78.31 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 120.666 0.27 . . . . 75.109999999999999 110.371 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.467 ' HB3' ' HB2' ' A' ' 73' ' ' TYR . . . -62.47 -39.14 92.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.367 -0.379 . . . . 74.519999999999996 111.104 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -73.3 -34.94 66.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.146 0.498 . . . . 65.439999999999998 110.339 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -80.94 -30.4 35.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.604 -0.725 . . . . 74.510000000000005 110.585 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . 0.434 ' HB3' HD12 ' A' ' 77' ' ' LEU . 10.7 t-20 -77.46 -40.59 42.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 72.120000000000005 110.824 -178.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -62.35 -17.82 59.9 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.098 0.475 . . . . 75.439999999999998 111.274 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -59.32 -26.87 65.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.284 -0.871 . . . . 75.329999999999998 111.307 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.434 ' O ' HG21 ' B' ' 250' ' ' THR . 67.4 m-85 -89.6 1.36 56.09 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.373 -0.376 . . . . 75.400000000000006 111.511 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.481 ' C ' ' HE2' ' B' ' 258' ' ' MET . . . -63.72 -29.47 74.83 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.067 -1.063 . . . . 72.310000000000002 111.144 175.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 22.5 m -71.15 -6.97 43.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.102 0.408 . . . . 73.409999999999997 112.102 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 250' ' ' THR . . . . . 0.434 HG21 ' O ' ' B' ' 247' ' ' PHE . 12.8 t -115.6 16.99 16.46 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.0 0.429 . . . . 72.109999999999999 110.623 176.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.2 t -83.97 -59.16 2.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.346 -0.388 . . . . 74.420000000000002 110.876 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.71 ' CE2' ' HG2' ' B' ' 261' ' ' LYS . 1.6 m-85 -126.96 172.97 9.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.618 0.247 . . . . 72.200000000000003 111.006 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -94.1 -42.55 8.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.053 -0.522 . . . . 70.400000000000006 111.727 -173.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 50.7 p -100.16 154.12 18.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.508 -0.315 . . . . 71.540000000000006 110.39 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -65.1 -30.75 71.71 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.9 -0.32 . . . . 71.140000000000001 110.595 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -66.85 -45.93 76.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.014 0.435 . . . . 73.409999999999997 110.88 -178.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.566 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 22.8 mt-30 -80.19 -24.77 40.08 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.147 -0.479 . . . . 73.409999999999997 110.768 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.481 ' HE2' ' C ' ' B' ' 248' ' ' GLY . 20.3 ttt -76.34 -39.24 54.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.459 . . . . 71.519999999999996 110.214 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.554 ' HB2' HG23 ' A' ' 85' ' ' ILE . 33.0 tt0 -67.8 -49.01 64.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.611 . . . . 71.409999999999997 111.651 -177.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.26 66.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.128 0.49 . . . . 75.510000000000005 110.641 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.71 ' HG2' ' CE2' ' B' ' 252' ' ' PHE . 13.6 mptt -95.89 8.67 42.98 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.47 -0.787 . . . . 73.0 111.487 -175.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.624 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 15.2 ptpt -52.82 -45.74 67.43 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.309 -0.626 . . . . 74.540000000000006 109.309 175.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.624 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 10.2 tp60 -75.0 -24.07 58.34 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.99 -0.55 . . . . 73.540000000000006 110.858 -175.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.25 -46.31 74.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.571 0.224 . . . . 74.340000000000003 110.936 178.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.567 ' HE1' ' HA ' ' B' ' 262' ' ' LYS . 2.7 ptt? -78.4 -33.21 48.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.279 -0.568 . . . . 71.439999999999998 109.736 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.785 ' HE3' ' HB2' ' A' ' 78' ' ' ASP . 45.8 mtp -83.13 21.65 1.06 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.796 -0.638 . . . . 64.040000000000006 111.0 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 34.7 t70 -109.45 -25.08 10.69 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.659 -0.497 . . . . 62.130000000000003 109.659 174.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.465 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 18.3 p90 -113.81 -20.62 11.05 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.423 -0.511 . . . . 70.140000000000001 111.651 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -54.63 -48.24 72.5 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.097 0.475 . . . . 73.25 110.388 177.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.588 ' HG2' ' OD1' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -53.88 -47.67 70.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.238 -0.892 . . . . 65.420000000000002 110.584 175.568 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . 0.457 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 5.4 t70 -78.89 7.11 7.68 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.485 -1.234 . . . . 74.549999999999997 111.801 -170.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.465 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 6.9 mtp180 -84.02 -26.42 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.918 -0.489 . . . . 71.25 111.669 -171.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.781 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -106.9 15.07 25.84 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.707 -0.397 . . . . 75.439999999999998 110.258 179.15 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.427 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 26.3 ttmt -60.78 -53.82 52.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.96 -0.563 . . . . 75.209999999999994 110.71 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -64.31 -36.4 84.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.966 0.412 . . . . 72.129999999999995 110.801 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.4 mtt -58.91 -43.75 91.12 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 74.319999999999993 110.031 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.685 ' HB3' ' HE3' ' A' ' 66' ' ' MET . 1.3 tt -72.4 -39.1 68.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.303 -0.862 . . . . 72.0 109.753 -178.093 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.628 ' HB2' ' HE2' ' A' ' 66' ' ' MET . 20.6 t70 -62.19 -34.84 77.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.403 -0.817 . . . . 71.109999999999999 111.005 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -83.5 -6.94 59.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.594 -0.73 . . . . 74.129999999999995 111.913 -178.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -104.2 -3.77 23.95 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.571 -0.452 . . . . 75.409999999999997 111.24 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.483 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 42.0 mtt -89.82 -167.04 1.74 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.234 -0.439 . . . . 74.150000000000006 111.293 176.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.574 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.4 mt-10 70.29 -12.25 0.52 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.057 -0.974 . . . . 75.409999999999997 113.376 176.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -57.97 -57.76 11.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.051 0.453 . . . . 71.239999999999995 110.129 175.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -72.58 -16.24 61.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.043 -0.526 . . . . 65.510000000000005 111.475 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.558 HD11 ' HA ' ' B' ' 282' ' ' GLU . 56.1 mt -76.55 -56.98 6.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.488 -0.323 . . . . 75.129999999999995 110.234 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.3 pt-20 -62.18 -34.19 75.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 72.099999999999994 110.775 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -87.99 6.56 35.37 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.344 -0.389 . . . . 71.540000000000006 111.724 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.494 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 44.2 t80 -56.43 -47.76 78.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.321 -0.622 . . . . 64.420000000000002 109.321 174.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -59.59 -41.15 89.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.748 -0.66 . . . . 73.209999999999994 110.407 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -59.88 -54.52 45.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 75.120000000000005 110.349 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . 0.432 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 66.3 m-85 -62.53 -48.51 79.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.086 -0.506 . . . . 73.219999999999999 110.813 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.53 -19.61 57.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.036 -0.529 . . . . 75.219999999999999 111.16 -177.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.04 -37.02 13.7 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.973 -0.558 . . . . 74.319999999999993 110.889 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 38.5 p -75.32 -22.51 57.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 73.019999999999996 110.96 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 16.1 mt-30 -103.4 131.19 50.7 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.938 -0.574 . . . . 74.120000000000005 110.133 -177.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . 0.457 ' HD2' ' N ' ' B' ' 296' ' ' LYS . 9.9 mptt . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.355 -0.831 . . . . 74.299999999999997 109.097 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 110.022 -0.362 . . . . 63.240000000000002 110.022 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -78.18 -9.93 59.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.106 0.479 . . . . 72.409999999999997 111.016 -178.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.9 p-10 -99.84 149.7 23.11 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.9 -0.591 . . . . 75.430000000000007 109.81 176.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.582 ' HB3' ' HE2' ' A' ' 8' ' ' TYR . 37.5 tt0 -65.8 -81.12 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.234 -0.439 . . . . 74.209999999999994 111.19 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -124.14 -27.56 3.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.175 0.512 . . . . 73.120000000000005 110.24 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -106.38 167.86 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.004 -0.544 . . . . 71.540000000000006 111.329 -175.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.468 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -78.7 47.18 0.71 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.427 -0.806 . . . . 74.209999999999994 111.643 -178.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.582 ' HE2' ' HB3' ' A' ' 4' ' ' GLU . 75.2 m-85 -49.37 -48.54 46.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 73.310000000000002 111.591 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -26.27 67.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.041 -0.527 . . . . 74.219999999999999 112.2 -175.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.472 ' HD3' ' HA ' ' A' ' 10' ' ' ARG . 27.1 mmt180 -81.39 -51.49 8.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.269 -0.172 . . . . 71.109999999999999 111.404 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.628 ' HB1' ' HB3' ' B' ' 239' ' ' ALA . . . -63.6 -23.5 67.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.874 0.845 . . . . 70.439999999999998 109.701 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -58.63 -33.47 70.08 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.124 -1.398 . . . . 72.310000000000002 111.22 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.546 ' HB2' HD11 ' B' ' 217' ' ' LEU . 28.1 mt-10 -79.15 -31.9 44.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.374 0.607 . . . . 75.409999999999997 109.469 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.627 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -63.01 -43.46 98.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.019 -0.991 . . . . 75.25 109.533 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.662 HG21 ' HD2' ' B' ' 243' ' ' TYR . 84.9 mt -69.91 -33.09 54.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.348 -0.842 . . . . 72.450000000000003 110.598 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -31.14 71.19 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.9 -0.591 . . . . 74.549999999999997 111.055 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.498 HD11 HD22 ' B' ' 214' ' ' LEU . 2.8 tm? -69.71 -45.92 67.12 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.05 -0.722 . . . . 75.439999999999998 109.05 176.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.77 -39.27 84.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.968 -0.56 . . . . 72.329999999999998 110.808 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.91 -21.47 66.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.281 -0.418 . . . . 72.430000000000007 111.396 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -33.95 34.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.012 0.435 . . . . 72.5 109.865 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -78.69 -24.3 45.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.245 0.545 . . . . 75.430000000000007 110.025 177.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.461 ' OD1' HG22 ' A' ' 29' ' ' THR . 0.2 OUTLIER -70.49 -10.91 60.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.49 -0.777 . . . . 71.120000000000005 109.577 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -78.83 -9.75 59.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.584 -0.734 . . . . 75.120000000000005 110.737 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.42 HD21 HG13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -70.43 159.64 33.84 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.154 0.502 . . . . 75.450000000000003 110.977 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.6 t -121.37 -16.57 7.84 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.469 -0.787 . . . . 72.099999999999994 110.239 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.74 3.71 49.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.515 -0.766 . . . . 74.0 111.021 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.74 HG21 ' H ' ' A' ' 28' ' ' GLN . 1.6 mt -128.25 -174.72 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.129999999999995 109.742 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.832 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 41.5 mt-30 -120.4 160.57 22.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.389 -0.597 . . . . 73.340000000000003 109.389 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.536 HG23 ' CZ ' ' B' ' 247' ' ' PHE . 58.6 m -64.01 -38.56 91.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.024 0.44 . . . . 73.450000000000003 110.802 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.56 74.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.086 -0.578 . . . . 74.439999999999998 112.979 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.832 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 8.5 mm-40 -68.99 -35.76 77.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.312 0.577 . . . . 72.200000000000003 109.596 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.4 HG22 ' HA ' ' A' ' 22' ' ' ASN . 47.8 t -63.84 -43.97 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.176 -0.92 . . . . 71.400000000000006 109.819 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.1 t -61.08 -42.93 99.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.719 -0.673 . . . . 73.400000000000006 110.438 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.888 -0.596 . . . . 61.340000000000003 111.279 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.509 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 16.2 m -66.71 -33.13 74.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.775 -0.454 . . . . 74.340000000000003 109.775 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.633 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.0 t80 -67.11 -41.09 86.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.3 0.572 . . . . 73.549999999999997 109.538 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.692 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.0 ttm -64.65 -48.47 74.7 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.51 -0.768 . . . . 75.420000000000002 111.427 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.52 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 27.4 t-105 -64.21 -37.15 86.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.387 . . . . 74.340000000000003 110.916 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.562 ' HB2' ' HB3' ' B' ' 211' ' ' ALA . . . -65.44 -36.38 83.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.962 0.41 . . . . 74.439999999999998 110.657 178.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.742 HD23 ' SD ' ' B' ' 237' ' ' MET . 58.6 tp -68.52 -36.96 79.58 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 74.420000000000002 109.703 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -33.25 71.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.644 -0.707 . . . . 65.310000000000002 111.076 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -78.5 -52.51 8.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.13 -0.486 . . . . 74.430000000000007 110.733 178.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.44 ' HD2' HG22 ' B' ' 215' ' ' ILE . 20.2 t80 -65.42 -42.28 92.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.39 -0.823 . . . . 74.230000000000004 111.549 -173.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -80.24 -25.14 39.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.405 -0.362 . . . . 64.519999999999996 111.652 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.586 ' HB3' ' HG ' ' B' ' 277' ' ' LEU . . . -81.28 -21.03 39.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.081 0.467 . . . . 75.109999999999999 110.54 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.43 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 11.3 t90 -56.63 -32.92 65.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 71.129999999999995 110.553 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -72.51 -9.0 58.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 71.200000000000003 111.532 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.605 ' O ' ' HE1' ' A' ' 58' ' ' MET . . . -67.79 -30.92 74.86 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.468 -0.872 . . . . 70.129999999999995 111.066 174.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 t -71.62 -2.96 18.99 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.747 0.308 . . . . 53.329999999999998 111.212 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -127.25 16.18 7.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.194 0.521 . . . . 72.329999999999998 109.978 174.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.5 t -74.17 -47.9 32.74 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.943 -0.571 . . . . 75.010000000000005 111.203 -175.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.623 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -134.03 -176.09 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.126 0.489 . . . . 74.209999999999994 112.078 -176.48 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.623 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.2 pt-20 -97.63 -25.59 15.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.133 -0.939 . . . . 75.510000000000005 111.881 -171.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.534 ' HA ' ' CE2' ' B' ' 288' ' ' PHE . 67.7 p -135.92 157.76 46.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.199 -0.455 . . . . 73.510000000000005 109.785 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.545 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 9.8 ptmm? -71.64 -30.59 65.93 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.547 -0.461 . . . . 72.040000000000006 110.322 -177.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.74 -38.78 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 73.420000000000002 110.414 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.683 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 23.0 mt-30 -88.05 -38.14 15.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.74 -0.664 . . . . 70.409999999999997 110.265 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.605 ' HE1' ' O ' ' A' ' 48' ' ' GLY . 14.5 ttt -60.07 -40.86 91.01 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.144 0.497 . . . . 72.519999999999996 111.182 178.084 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -63.37 -31.39 72.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.607 -0.724 . . . . 74.239999999999995 110.823 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.78 1.89 47.79 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.044 -0.525 . . . . 64.310000000000002 111.07 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.683 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -111.9 -0.99 15.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.092 -0.504 . . . . 74.239999999999995 109.715 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -51.39 -62.7 1.46 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.413 -0.812 . . . . 72.530000000000001 110.285 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -75.64 -11.92 60.1 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.548 -0.751 . . . . 74.409999999999997 110.471 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.42 -49.89 17.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.668 . . . . 73.120000000000005 110.767 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.2 ptt? -79.76 -26.7 40.61 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.253 0.549 . . . . 75.430000000000007 109.846 -179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.592 ' HE2' ' HB2' ' B' ' 278' ' ' ASP . 92.4 mtp -79.14 -2.12 39.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.641 -0.709 . . . . 72.129999999999995 110.522 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -74.47 -27.57 60.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.418 -0.956 . . . . 73.019999999999996 108.418 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 26.5 m-85 -102.82 -30.12 11.04 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.111 -1.404 . . . . 75.349999999999994 111.995 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -56.28 -58.31 8.52 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.011 -0.737 . . . . 73.219999999999999 109.011 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.507 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -56.9 -59.53 4.9 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.499 -0.318 . . . . 75.120000000000005 110.992 173.31 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -107.42 75.59 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.703 0.631 . . . . 75.530000000000001 112.703 -170.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.463 ' HB2' ' O ' ' A' ' 68' ' ' TYR . 2.1 mmm180 -140.52 -29.95 0.67 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.841 -0.618 . . . . 74.430000000000007 110.323 166.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.639 ' HH ' ' HB3' ' B' ' 269' ' ' TYR . 0.1 OUTLIER -86.05 7.42 24.69 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.727 -0.842 . . . . 72.430000000000007 108.727 177.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.702 ' HA ' ' HE1' ' B' ' 270' ' ' MET . 11.9 tttp -59.59 -60.22 4.19 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.732 -1.122 . . . . 62.109999999999999 110.417 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.31 -32.39 73.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.89 -0.595 . . . . 73.010000000000005 111.517 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.465 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 53.0 mtt -59.76 -48.92 79.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.556 0.693 . . . . 74.430000000000007 109.321 172.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.707 HD23 ' HD2' ' B' ' 269' ' ' TYR . 17.6 tp -63.32 -38.27 90.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.416 -1.266 . . . . 74.120000000000005 110.628 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.605 ' HB2' ' HE2' ' B' ' 266' ' ' MET . 10.4 t70 -63.19 -53.93 45.48 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.771 -0.65 . . . . 72.319999999999993 110.199 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.12 -12.92 61.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.064 -0.971 . . . . 71.150000000000006 111.604 -178.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.0 -10.26 39.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.383 -0.371 . . . . 74.439999999999998 110.939 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.456 ' O ' HG13 ' A' ' 85' ' ' ILE . 63.4 mtt -101.12 -55.28 2.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 72.209999999999994 111.246 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.568 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 11.5 pt-20 -68.64 -14.89 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.852 0.686 . . . . 73.450000000000003 112.852 -169.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.09 -33.27 70.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.445 -0.576 . . . . 63.439999999999998 109.445 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -77.23 -38.41 51.28 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.859 -0.61 . . . . 75.340000000000003 110.215 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.703 HG12 ' HE3' ' B' ' 258' ' ' MET . 68.1 mt -59.22 -54.84 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.854 -0.612 . . . . 72.409999999999997 110.932 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.802 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 8.4 pt-20 -58.82 -33.87 70.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.454 -0.339 . . . . 74.200000000000003 111.559 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -94.24 17.51 12.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.681 -0.236 . . . . 71.040000000000006 111.497 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.487 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 22.2 t80 -53.14 -51.69 61.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.707 -0.224 . . . . 74.409999999999997 110.996 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -59.85 -28.7 67.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.246 -0.434 . . . . 75.140000000000001 111.27 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -71.67 -53.25 14.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.98 0.419 . . . . 75.019999999999996 110.01 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.478 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 75.0 m-85 -64.17 -35.43 80.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.228 -0.442 . . . . 73.409999999999997 110.833 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.408 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 0.3 OUTLIER -70.45 -8.22 49.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.593 0.711 . . . . 74.530000000000001 110.511 178.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -98.9 -26.78 14.17 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.957 -0.565 . . . . 72.239999999999995 110.583 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 46.8 p -84.92 -30.25 24.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.101 -0.499 . . . . 62.210000000000001 110.888 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 0.2 OUTLIER -119.14 155.66 31.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.946 0.403 . . . . 73.439999999999998 110.286 178.132 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.701 ' HB2' ' HZ2' ' A' ' 96' ' ' LYS . 9.5 mtmp? . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 115.827 -0.624 . . . . 73.030000000000001 110.735 -175.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 120.754 0.311 . . . . 55.100000000000001 110.541 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -69.86 -21.93 63.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.107 0.48 . . . . 74.400000000000006 110.777 178.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.524 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.3 p-10 -154.96 136.28 14.06 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.053 -0.721 . . . . 74.430000000000007 109.053 173.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.46 -92.51 0.12 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.88 0.371 . . . . 73.519999999999996 110.975 -176.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -95.4 -28.75 14.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.437 0.637 . . . . 73.319999999999993 109.483 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.524 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -103.87 160.58 14.68 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.26 -0.882 . . . . 70.409999999999997 110.882 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.52 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.2 OUTLIER -82.06 48.34 1.23 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.978 -1.01 . . . . 65.299999999999997 111.617 -177.641 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.488 ' HD2' ' HA ' ' B' ' 203' ' ' ASN . 53.7 m-85 -46.98 -53.55 12.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.242 -0.435 . . . . 75.099999999999994 111.921 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . 0.405 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -58.88 -36.4 74.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.897 -0.592 . . . . 74.329999999999998 112.247 -176.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.472 ' O ' HD21 ' B' ' 214' ' ' LEU . 35.7 mmt180 -71.63 -48.94 44.58 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 111.75 0.278 . . . . 70.439999999999998 111.75 -176.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.562 ' HB3' ' HB2' ' A' ' 39' ' ' ALA . . . -63.88 -26.54 68.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.951 0.882 . . . . 75.430000000000007 109.585 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 212' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 3.1 m -62.54 -32.73 73.73 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.254 -1.339 . . . . 71.349999999999994 111.611 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.438 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 32.8 mt-10 -75.35 -28.75 59.71 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.553 0.692 . . . . 74.120000000000005 109.247 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.633 HD12 ' CD1' ' A' ' 36' ' ' PHE . 3.4 mm? -65.37 -44.39 87.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.996 -1.002 . . . . 75.329999999999998 109.578 176.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.44 HG22 ' HD2' ' A' ' 43' ' ' TYR . 75.2 mt -69.15 -27.93 36.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.441 -0.799 . . . . 73.150000000000006 110.389 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.438 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 14.2 tmtt? -60.15 -35.09 74.53 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.079 -0.51 . . . . 64.329999999999998 110.931 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.546 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.0 tm? -69.77 -42.25 74.07 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.968 -0.753 . . . . 74.129999999999995 108.968 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.33 84.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.84 -0.618 . . . . 74.010000000000005 110.797 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 93.6 m-20 -60.61 -26.11 66.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 72.219999999999999 111.165 179.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -31.85 43.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.594 -0.276 . . . . 72.439999999999998 111.2 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -80.69 -28.06 36.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.479 0.656 . . . . 72.519999999999996 110.594 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -75.44 -1.47 24.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.185 -0.916 . . . . 75.120000000000005 110.672 -178.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.9 mm-40 -79.28 -0.56 32.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.06 -0.518 . . . . 73.310000000000002 111.613 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.992 HD21 HG13 ' B' ' 227' ' ' ILE . 43.2 t30 -80.06 164.9 23.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.015 0.436 . . . . 72.209999999999994 110.49 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 1.5 t -96.18 -40.11 9.35 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.82 -0.627 . . . . 50.420000000000002 112.468 -173.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.16 3.18 43.64 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 112.91 0.707 . . . . 75.239999999999995 112.91 -175.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.992 HG13 HD21 ' B' ' 224' ' ' ASN . 12.7 mt -94.88 147.41 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 C-N-CA 120.192 -0.603 . . . . 75.219999999999999 109.565 175.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.56 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 37.2 mt-30 -84.01 147.37 27.46 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.569 -0.741 . . . . 73.409999999999997 109.365 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 7.8 m -57.3 -27.43 62.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.277 0.561 . . . . 71.349999999999994 110.282 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -76.65 -21.16 75.4 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.577 -0.738 . . . . 62.100000000000001 113.41 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.56 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 12.4 mm-40 -72.29 -30.98 65.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.64 0.72 . . . . 60.420000000000002 110.088 -176.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.3 t -69.73 -39.85 78.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.293 -0.867 . . . . 73.019999999999996 109.502 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.9 t -62.56 -38.49 90.29 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.78 -0.645 . . . . 73.200000000000003 109.744 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.27 -36.33 82.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.949 -0.568 . . . . 72.310000000000002 110.796 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.468 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.2 m -66.44 -35.21 79.74 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.686 -0.487 . . . . 73.129999999999995 109.686 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.542 ' CD1' HD11 ' A' ' 14' ' ' LEU . 2.0 t80 -66.96 -37.57 84.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.774 -0.648 . . . . 74.549999999999997 109.655 176.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.742 ' SD ' HD23 ' A' ' 40' ' ' LEU . 8.6 tpt -63.64 -52.45 60.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 75.340000000000003 110.729 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.465 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 22.3 t-105 -63.48 -38.41 91.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.96 -0.564 . . . . 74.409999999999997 111.332 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.628 ' HB3' ' HB1' ' A' ' 11' ' ' ALA . . . -65.72 -31.85 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.547 -0.297 . . . . 75.409999999999997 111.392 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.46 HD23 ' HE2' ' A' ' 37' ' ' MET . 44.4 tp -64.85 -38.52 91.27 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.864 -0.421 . . . . 75.209999999999994 109.864 177.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.524 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 72.150000000000006 110.312 177.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . 0.414 ' HA ' ' NE ' ' B' ' 242' ' ' ARG . 1.0 OUTLIER -58.68 -48.86 79.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 75.219999999999999 111.53 178.022 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.662 ' HD2' HG21 ' A' ' 15' ' ' ILE . 11.3 t80 -75.33 -36.85 60.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.968 -0.56 . . . . 73.340000000000003 111.494 -173.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -74.88 -40.52 60.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.835 0.35 . . . . 74.109999999999999 111.266 -176.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . 0.451 ' HA ' ' HE3' ' A' ' 81' ' ' MET . . . -66.82 -22.47 66.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.932 0.396 . . . . 62.229999999999997 111.272 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 13.2 t90 -57.56 -31.81 66.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.606 -0.724 . . . . 72.409999999999997 110.565 175.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.536 ' CZ ' HG23 ' A' ' 29' ' ' THR . 71.3 m-85 -74.79 -11.03 60.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.238 -0.437 . . . . 73.019999999999996 111.526 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.535 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -70.13 -31.35 69.27 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.477 -0.868 . . . . 55.340000000000003 111.186 175.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 22.6 t -74.15 -7.84 54.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.807 0.337 . . . . 70.349999999999994 110.942 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -120.86 21.59 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.354 0.597 . . . . 73.109999999999999 109.613 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 7.2 t -91.0 -38.69 12.66 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.691 -0.686 . . . . 62.200000000000003 111.289 -175.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.599 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -138.0 -170.07 2.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.204 0.526 . . . . 75.519999999999996 111.955 -176.888 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' B' ' 254' ' ' THR . 14.7 pt-20 -100.38 -49.82 4.12 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.349 -0.842 . . . . 75.030000000000001 111.237 -176.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.407 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 70.4 p -111.28 155.98 22.2 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.521 -0.309 . . . . 65.540000000000006 110.391 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.802 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 5.9 ptmm? -68.29 -27.26 66.16 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.812 -0.355 . . . . 62.32 110.588 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.25 -53.86 53.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.135 0.493 . . . . 71.319999999999993 110.327 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.678 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 14.4 mt-30 -79.1 -36.01 41.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.717 -0.674 . . . . 73.310000000000002 110.372 -177.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.703 ' HE3' HG12 ' A' ' 85' ' ' ILE . 20.4 ttt -61.9 -40.04 94.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.747 -0.661 . . . . 53.149999999999999 111.047 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.643 ' HA ' HD13 ' A' ' 85' ' ' ILE . 4.8 tp-100 -59.98 -41.57 92.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.957 -0.565 . . . . 70.109999999999999 110.823 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.99 -17.29 62.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.777 -0.647 . . . . 74.540000000000006 111.064 -178.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.678 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.3 mmmt -91.58 -18.16 24.5 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 110.523 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.414 ' HZ3' ' CG ' ' A' ' 78' ' ' ASP . 31.2 ttpt -48.41 -61.64 1.91 Allowed 'General case' 0 N--CA 1.443 -0.818 0 O-C-N 123.709 0.63 . . . . 71.349999999999994 110.439 -178.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.01 -26.02 65.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.004 -0.544 . . . . 73.129999999999995 111.021 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -74.26 -35.94 63.81 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.988 -0.285 . . . . 75.219999999999999 111.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 19.0 ptp -83.65 -25.32 30.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.104 -0.702 . . . . 61.409999999999997 109.104 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.605 ' HE2' ' HB2' ' A' ' 78' ' ' ASP . 58.9 mtp -80.7 -24.67 38.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.16 -0.927 . . . . 73.409999999999997 111.784 179.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.18 -35.69 71.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.909 0.385 . . . . 65.519999999999996 111.93 -168.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.591 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 25.2 p90 -103.33 -3.41 25.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.291 -0.413 . . . . 70.140000000000001 110.903 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.707 ' HD2' HD23 ' A' ' 77' ' ' LEU . 2.1 m-30 -65.84 -42.72 90.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.452 0.168 . . . . 75.409999999999997 111.115 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.702 ' HE1' ' HA ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -57.23 -44.62 83.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.538 0.685 . . . . 75.239999999999995 109.577 174.779 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -86.06 17.39 3.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.98 -1.009 . . . . 73.349999999999994 111.621 -172.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 2.0 mmm180 -89.61 -47.88 7.67 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.501 -0.749 . . . . 73.439999999999998 110.94 -174.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.692 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.22 12.23 33.63 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.099 0.476 . . . . 72.239999999999995 109.796 -176.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -58.43 -57.98 10.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.41 -0.814 . . . . 73.519999999999996 110.341 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -60.76 -37.99 83.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.723 -0.671 . . . . 64.200000000000003 111.111 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 48.9 mtt -59.59 -45.55 91.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.433 0.635 . . . . 73.340000000000003 110.092 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.611 HD21 ' HE2' ' B' ' 281' ' ' MET . 6.3 tt -71.56 -42.1 68.26 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.175 -0.92 . . . . 73.439999999999998 110.413 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.592 ' HB2' ' HE2' ' A' ' 66' ' ' MET . 12.1 t70 -56.8 -41.98 78.68 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.468 0.651 . . . . 71.450000000000003 110.301 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.06 -13.32 62.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.902 -1.044 . . . . 73.129999999999995 112.189 -177.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -98.9 -7.95 26.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.987 0.422 . . . . 75.209999999999994 110.391 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.611 ' HE2' HD21 ' B' ' 277' ' ' LEU . 55.1 mtt -94.19 -50.77 5.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.221 -0.445 . . . . 74.019999999999996 111.08 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 0.0 OUTLIER -57.13 -25.8 59.45 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.49 -0.777 . . . . 72.530000000000001 111.968 -173.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.56 -42.57 92.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.055 -0.52 . . . . 64.019999999999996 110.448 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -82.36 -34.47 28.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 71.450000000000003 110.516 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.445 HG13 ' O ' ' B' ' 281' ' ' MET . 69.0 mt -58.22 -58.02 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 116.228 -0.442 . . . . 75.200000000000003 111.677 -177.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.0 pt-20 -64.49 -29.06 70.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.34 -0.391 . . . . 74.120000000000005 111.346 -175.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -100.04 12.45 36.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.721 -0.218 . . . . 64.530000000000001 111.342 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.545 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 78.3 t80 -55.31 -56.94 14.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.727 -0.215 . . . . 71.0 111.19 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.98 -21.69 66.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.82 0.343 . . . . 71.329999999999998 110.598 -176.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -66.33 -52.99 41.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.425 -0.583 . . . . 65.010000000000005 109.425 175.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -66.87 -38.21 85.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.332 0.587 . . . . 73.209999999999994 110.334 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.434 ' HA ' ' HG2' ' B' ' 295' ' ' GLN . 3.7 tmm_? -67.29 -17.69 64.88 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.131 -0.941 . . . . 73.450000000000003 110.284 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.6 -25.74 19.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 75.420000000000002 111.032 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 32.7 p -91.92 -18.71 23.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.322 -0.399 . . . . 62.310000000000002 111.153 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' B' ' 292' ' ' ARG . 18.5 pt20 -80.83 142.78 33.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.483 0.659 . . . . 73.109999999999999 110.614 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 50.3 mttp . . . . . 0 C--O 1.247 0.972 0 CA-C-N 115.185 -0.916 . . . . 74.420000000000002 108.949 178.369 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.4 t . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 120.61 0.243 . . . . 73.329999999999998 110.497 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -81.51 148.61 29.1 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.071 -0.344 . . . . 63.200000000000003 110.071 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.7 p-10 -77.9 136.83 38.09 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.483 -0.562 . . . . 62.32 109.483 175.547 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -67.99 -83.4 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.438 . . . . 75.109999999999999 111.0 -176.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -111.9 -42.16 3.85 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.854 -0.612 . . . . 71.409999999999997 109.511 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.709 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -93.45 154.02 18.16 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.859 -0.61 . . . . 75.400000000000006 110.097 174.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.439 ' HB2' ' HD2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -78.36 51.91 1.08 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.602 -0.726 . . . . 74.109999999999999 112.478 -177.333 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -51.91 -46.95 64.81 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.847 0.356 . . . . 73.030000000000001 111.46 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.2 -6.07 36.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.913 -0.585 . . . . 75.430000000000007 112.359 -173.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.439 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 84.7 mtt180 -100.11 -60.71 1.48 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.926 -0.398 . . . . 74.549999999999997 109.926 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.691 ' HA ' HD22 ' A' ' 14' ' ' LEU . . . -54.27 -25.65 24.63 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.594 0.59 . . . . 72.400000000000006 112.594 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.9 t -62.13 -26.53 68.37 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.743 -0.208 . . . . 73.049999999999997 111.362 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.536 ' HB2' HD11 ' B' ' 217' ' ' LEU . 26.5 mt-10 -84.39 -25.14 29.3 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.354 0.597 . . . . 75.25 109.705 -178.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.691 HD22 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -68.56 -49.53 58.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.31 -0.859 . . . . 72.109999999999999 109.203 177.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.539 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.2 mt -64.91 -29.28 46.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.643 -0.708 . . . . 73.430000000000007 109.807 175.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -62.5 -38.0 88.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.804 -0.634 . . . . 74.219999999999999 111.085 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.488 HD11 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -65.92 -47.42 74.83 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.873 -0.788 . . . . 65.120000000000005 108.873 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.59 -35.85 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.39 -0.823 . . . . 73.450000000000003 110.969 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.609 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 5.1 m-80 -58.94 -34.5 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 75.109999999999999 111.347 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.0 -41.58 67.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.242 -0.435 . . . . 73.340000000000003 111.271 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -74.11 -20.51 60.23 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.346 0.593 . . . . 73.219999999999999 109.909 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.559 HD22 HG23 ' A' ' 29' ' ' THR . 2.9 t-20 -83.51 -4.91 58.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.302 -0.863 . . . . 74.439999999999998 110.751 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 26.4 mt-30 -82.54 17.83 1.67 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.396 -0.365 . . . . 73.049999999999997 111.162 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.837 HD21 HG13 ' A' ' 27' ' ' ILE . 18.6 t30 -105.33 156.96 17.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.759 0.314 . . . . 72.400000000000006 110.616 -177.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 t -100.63 -37.02 8.94 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.837 0.68 . . . . 72.439999999999998 112.837 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.8 pm0 -85.23 -2.44 58.05 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.752 -0.379 . . . . 72.420000000000002 110.951 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.837 HG13 HD21 ' A' ' 24' ' ' ASN . 8.6 mt -96.91 145.44 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.526 0.679 . . . . 73.120000000000005 110.252 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.632 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 9.0 mt-30 -79.66 140.71 36.97 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.716 -1.129 . . . . 73.319999999999993 108.105 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.559 HG23 HD22 ' A' ' 22' ' ' ASN . 17.4 m -58.38 -24.83 61.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.987 0.422 . . . . 72.209999999999994 111.06 -176.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -82.17 -11.73 81.9 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.868 -0.605 . . . . 73.049999999999997 113.833 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.632 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 50.2 mt-10 -70.21 -31.31 68.68 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 117.97 0.885 . . . . 70.540000000000006 110.286 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 19.0 t -79.45 -32.76 14.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.642 -0.708 . . . . 64.109999999999999 109.901 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.407 ' HG ' ' HE2' ' B' ' 247' ' ' PHE . 0.7 OUTLIER -63.66 -42.57 98.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.608 -0.723 . . . . 73.25 110.202 177.354 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.04 -36.22 81.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.624 -0.716 . . . . 74.219999999999999 111.177 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.446 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 3.6 p -71.96 -27.71 62.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.420000000000002 110.458 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.589 ' CD1' HD11 ' B' ' 214' ' ' LEU . 11.4 t80 -69.6 -37.57 76.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.415 -0.587 . . . . 72.209999999999994 109.415 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.721 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 12.1 ttt -72.73 -49.85 28.4 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.892 -0.595 . . . . 75.219999999999999 111.104 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -52.4 -41.66 63.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.497 -0.774 . . . . 75.549999999999997 110.831 174.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.566 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.97 -33.78 76.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 74.340000000000003 111.348 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.564 HD21 ' HG3' ' B' ' 237' ' ' MET . 58.3 tp -65.65 -35.64 81.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.024 0.44 . . . . 72.430000000000007 110.136 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.439 ' HB2' ' HA ' ' B' ' 277' ' ' LEU . . . -63.4 -44.26 95.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.783 -0.644 . . . . 74.150000000000006 110.715 178.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -67.21 -24.12 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.215 -0.448 . . . . 64.349999999999994 110.99 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.414 ' HD1' HG22 ' B' ' 215' ' ' ILE . 3.1 t80 -90.02 -47.43 7.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.29 -0.414 . . . . 65.120000000000005 110.836 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -65.44 -26.04 67.79 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.1 0.407 . . . . 73.129999999999995 112.1 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.43 -14.53 62.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.787 0.327 . . . . 72.340000000000003 111.259 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -61.58 -31.92 72.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 75.049999999999997 110.342 176.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.869 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 55.0 m-85 -70.65 -12.99 61.9 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.173 -0.467 . . . . 75.230000000000004 111.226 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.49 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -65.54 -32.63 83.91 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.22 -0.991 . . . . 62.219999999999999 110.643 173.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.755 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 15.3 m -78.23 -9.57 59.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.009 0.433 . . . . 34.439999999999998 110.857 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 63.2 p -106.71 -3.1 20.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.184 0.516 . . . . 61.030000000000001 110.324 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.1 t -72.84 -43.37 62.73 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.67 -0.696 . . . . 75.030000000000001 110.522 -175.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.451 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 11.0 m-85 -149.72 178.1 9.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.921 -0.582 . . . . 71.140000000000001 110.596 -177.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.6 pt-20 -98.61 -52.65 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.059 -0.519 . . . . 74.349999999999994 111.129 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.411 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.6 p -88.01 148.59 24.45 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 116.596 -0.275 . . . . 72.430000000000007 110.523 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.437 ' HB2' ' HE2' ' A' ' 55' ' ' LYS . 7.8 ptmm? -66.28 -25.34 66.82 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.869 -0.332 . . . . 75.109999999999999 110.62 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -64.59 -41.65 96.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.437 . . . . 71.510000000000005 110.613 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.71 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.6 mt-30 -85.93 -37.99 18.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.996 -0.547 . . . . 71.349999999999994 109.806 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.755 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.6 ttt -63.88 -43.43 96.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.586 -0.734 . . . . 63.329999999999998 111.618 -177.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.573 ' HA ' HD13 ' B' ' 285' ' ' ILE . 42.9 tt0 -68.86 -34.92 76.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.36 -0.382 . . . . 75.530000000000001 111.154 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.07 2.56 10.35 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.205 -0.452 . . . . 73.140000000000001 111.613 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.6 mmmt -113.52 -2.44 13.87 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 110.092 -0.336 . . . . 73.340000000000003 110.092 -177.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.74 -57.9 6.38 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 123.721 0.638 . . . . 75.420000000000002 110.889 -175.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -80.07 -20.96 43.98 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 110.254 -0.276 . . . . 74.239999999999995 110.254 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -73.53 -39.61 64.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 63.420000000000002 111.866 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.49 ' SD ' ' HA2' ' A' ' 48' ' ' GLY . 2.5 ptt? -84.32 -19.12 34.24 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 119.9 -0.72 . . . . 72.109999999999999 109.483 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.477 ' HE3' ' HB2' ' B' ' 278' ' ' ASP . 46.0 mtp -85.35 -21.85 28.72 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.276 -0.874 . . . . 73.150000000000006 111.35 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.114 0.483 . . . . 72.109999999999999 111.072 -171.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.583 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.6 p90 -96.99 -8.12 31.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.863 -0.608 . . . . 75.239999999999995 111.073 -178.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.509 ' HD2' HD23 ' B' ' 277' ' ' LEU . 2.6 m-30 -61.4 -40.16 93.38 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 120.576 0.227 . . . . 72.349999999999994 111.009 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.6 ' SD ' ' HE3' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -55.69 -50.75 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.323 0.582 . . . . 73.109999999999999 110.224 174.795 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.524 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 1.9 t70 -88.02 27.45 1.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.238 -0.892 . . . . 71.200000000000003 111.467 -170.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.583 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 17.3 mmm180 -91.95 -54.45 3.85 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.17 -0.331 . . . . 70.430000000000007 111.317 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.711 ' HB3' ' HG2' ' B' ' 237' ' ' MET . 0.1 OUTLIER -79.33 5.62 12.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.181 0.515 . . . . 71.209999999999994 110.527 -177.372 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.74 -45.93 92.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.501 -0.772 . . . . 73.400000000000006 110.684 -179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.51 -33.11 74.96 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.726 -0.67 . . . . 72.349999999999994 111.097 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -69.2 -41.1 77.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.341 0.591 . . . . 64.530000000000001 109.951 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.805 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 0.7 OUTLIER -65.36 -38.84 91.26 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.906 -1.043 . . . . 74.230000000000004 111.423 -174.539 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -65.21 -33.56 76.29 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.1 0.476 . . . . 52.450000000000003 110.795 -178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.96 -14.84 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.895 -0.593 . . . . 73.349999999999994 110.753 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -92.22 -20.39 21.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.555 . . . . 71.439999999999998 110.383 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.459 ' C ' ' H ' ' A' ' 83' ' ' ASP . 24.0 mmt -77.2 -168.26 1.07 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.935 -0.575 . . . . 63.329999999999998 110.936 177.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 1.038 ' HA ' HD12 ' A' ' 85' ' ' ILE . 48.6 mt-10 66.98 -7.69 0.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.994 -1.003 . . . . 72.129999999999995 112.201 -178.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.472 ' O ' HG13 ' A' ' 85' ' ' ILE . 41.8 t0 -79.15 150.61 31.67 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.732 -0.84 . . . . 75.510000000000005 108.732 172.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.463 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 3.1 m-85 73.13 -40.92 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.589 1.155 . . . . 74.430000000000007 110.672 -172.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 1.038 HD12 ' HA ' ' A' ' 82' ' ' GLU . 7.4 mt -56.72 -57.63 8.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.269 -0.878 . . . . 73.319999999999993 111.131 177.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.468 ' HG3' ' ND2' ' A' ' 87' ' ' ASN . 7.9 pt-20 -57.75 -26.54 61.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.172 -0.922 . . . . 71.530000000000001 111.356 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.468 ' ND2' ' HG3' ' A' ' 86' ' ' GLU . 56.6 m-80 -100.43 2.82 42.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.409999999999997 111.47 -175.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.541 ' O ' ' HB2' ' A' ' 92' ' ' ARG . 59.3 t80 -58.72 -48.22 81.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 72.329999999999998 110.452 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.77 -31.74 73.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.079 -0.51 . . . . 74.409999999999997 110.334 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -63.12 -55.91 21.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.783 -0.644 . . . . 75.329999999999998 110.013 177.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -64.04 -43.43 95.56 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 74.129999999999995 110.703 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.541 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -63.26 -20.17 65.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.806 -0.634 . . . . 73.200000000000003 111.307 -179.019 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -88.78 -35.35 16.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.122 -0.49 . . . . 65.439999999999998 110.791 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.2 p -80.73 -34.16 34.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.089 -0.505 . . . . 72.209999999999994 111.46 -178.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -75.72 153.03 37.33 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.931 0.396 . . . . 52.299999999999997 110.176 -178.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 57.2 mttp . . . . . 0 C--N 1.321 -0.653 0 CA-C-N 116.094 -0.503 . . . . 74.129999999999995 110.594 -175.014 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' SER . . . . . 0.421 ' HA ' ' CB ' ' B' ' 209' ' ' ALA . 32.0 t . . . . . 0 C--O 1.234 0.264 0 CA-C-O 121.133 0.492 . . . . 72.519999999999996 110.191 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -94.85 104.97 16.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.121 -0.49 . . . . 74.439999999999998 110.251 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -90.97 154.69 19.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 73.209999999999994 111.056 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.62 -86.51 0.15 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.997 -0.547 . . . . 63.149999999999999 110.321 173.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -111.6 -24.83 9.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.063 0.459 . . . . 62.119999999999997 110.546 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -94.76 -160.41 0.78 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.942 -0.572 . . . . 71.140000000000001 111.608 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.446 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -127.29 44.47 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.649 -0.705 . . . . 72.400000000000006 110.907 -176.575 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -52.89 -49.11 66.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.936 -0.575 . . . . 74.439999999999998 111.927 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . 0.421 ' CB ' ' HA ' ' B' ' 201' ' ' SER . . . -58.99 -25.57 63.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.82 -0.627 . . . . 65.329999999999998 112.027 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -82.64 -60.64 2.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 110.184 -0.302 . . . . 73.519999999999996 110.184 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.552 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -56.69 -27.29 58.6 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.872 0.693 . . . . 72.230000000000004 112.872 -176.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.1 t -68.59 -20.16 64.5 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.851 0.358 . . . . 73.230000000000004 110.976 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -80.81 -31.5 35.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.479 0.657 . . . . 75.150000000000006 109.283 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.589 HD11 ' CD1' ' A' ' 36' ' ' PHE . 3.6 mm? -66.4 -50.58 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.867 -1.06 . . . . 74.209999999999994 110.017 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.566 HG13 ' HB1' ' A' ' 39' ' ' ALA . 75.0 mt -63.82 -32.05 55.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.878 -0.601 . . . . 74.140000000000001 110.373 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -60.11 -34.09 73.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.462 -0.79 . . . . 71.439999999999998 110.985 -177.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.601 HD13 HD11 ' A' ' 14' ' ' LEU . 3.3 tm? -69.7 -40.42 76.34 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.288 -0.634 . . . . 70.510000000000005 109.288 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -63.06 -31.83 73.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.014 -0.539 . . . . 73.310000000000002 110.674 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.74 -31.62 72.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 73.230000000000004 110.76 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.11 -18.05 53.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.114 -0.494 . . . . 73.219999999999999 111.131 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . 0.4 ' OE1' HD21 ' A' ' 14' ' ' LEU . 70.5 mt-30 -92.38 -25.04 18.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.232 0.539 . . . . 74.030000000000001 110.021 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -79.14 4.46 14.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.753 -0.658 . . . . 73.319999999999993 109.968 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -73.47 -10.68 59.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.012 -0.736 . . . . 75.109999999999999 109.012 172.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.633 HD21 ' HG2' ' B' ' 226' ' ' GLU . 2.7 m120 -77.78 134.87 37.95 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.078 -0.964 . . . . 62.43 110.855 175.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.5 t -115.35 -15.63 11.54 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.397 -0.819 . . . . 73.420000000000002 108.823 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . 0.633 ' HG2' HD21 ' B' ' 224' ' ' ASN . 1.6 pm0 -76.52 -22.76 53.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.969 -1.014 . . . . 75.510000000000005 110.423 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.401 HG21 ' N ' ' B' ' 228' ' ' GLN . 10.0 mt -98.29 156.37 3.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.269 -0.423 . . . . 73.319999999999993 109.941 177.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.526 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 11.7 mt-30 -76.01 138.88 41.19 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.519 -0.548 . . . . 75.310000000000002 109.519 174.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 26.9 m -60.14 -29.72 68.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.532 . . . . 72.450000000000003 110.436 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.869 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -63.93 -26.8 70.45 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 115.62 -0.718 . . . . 70.129999999999995 113.048 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.526 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 34.5 mt-10 -72.8 -31.19 64.67 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 117.233 0.517 . . . . 72.549999999999997 110.468 -177.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 43.7 t -73.3 -36.9 50.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.355 0.597 . . . . 75.409999999999997 110.265 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 5.9 t -72.36 -37.75 68.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.957 -0.565 . . . . 74.519999999999996 109.73 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.36 -33.05 73.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.822 -0.627 . . . . 62.420000000000002 111.383 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 3.5 p -69.52 -28.79 66.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.795 0.331 . . . . 62.520000000000003 110.456 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.605 ' CD1' HD12 ' A' ' 14' ' ' LEU . 7.7 t80 -69.77 -37.07 76.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.536 0.684 . . . . 72.430000000000007 109.17 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.711 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 11.1 ttt -71.76 -52.91 15.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.451 -0.795 . . . . 64.409999999999997 111.251 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 14.1 t-105 -52.35 -39.9 61.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.49 -0.777 . . . . 75.010000000000005 111.061 175.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.539 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.43 -36.76 84.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 75.450000000000003 111.126 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 57.7 tp -65.82 -35.18 79.97 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.864 0.364 . . . . 70.219999999999999 110.33 179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.77 73.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 74.349999999999994 110.781 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -64.66 -33.59 76.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.099 -0.501 . . . . 73.109999999999999 110.84 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -74.36 -39.55 62.69 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.947 -0.569 . . . . 75.329999999999998 111.021 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.13 -24.1 51.69 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.936 0.347 . . . . 71.299999999999997 111.936 -178.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -70.19 -17.48 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 72.239999999999995 111.089 179.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -59.0 -38.11 78.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.851 -0.613 . . . . 74.409999999999997 110.251 175.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.407 ' HE2' ' HG ' ' A' ' 33' ' ' SER . 87.6 m-85 -75.81 3.22 10.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.625 -0.716 . . . . 73.140000000000001 111.82 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.49 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -65.39 -35.01 90.88 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 119.983 -1.103 . . . . 72.439999999999998 110.438 171.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 249' ' ' SER . . . . . 0.633 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 78.9 p -77.66 -6.67 54.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.285 -0.458 . . . . 64.230000000000004 111.362 -177.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 62.4 p -109.38 -1.94 18.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.085 0.469 . . . . 70.140000000000001 110.408 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 24.0 t -81.44 -39.8 24.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.721 -0.672 . . . . 72.530000000000001 110.771 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.669 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 1.7 m-85 -145.13 178.71 7.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.132 0.492 . . . . 73.430000000000007 112.075 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.452 ' HG3' HG22 ' B' ' 254' ' ' THR . 13.5 pt-20 -104.5 -43.91 5.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.269 -0.878 . . . . 74.230000000000004 111.516 -172.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.452 HG22 ' HG3' ' B' ' 253' ' ' GLU . 45.7 p -104.77 149.4 25.66 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 116.523 -0.308 . . . . 64.409999999999997 110.287 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.408 ' HB2' ' HE2' ' B' ' 255' ' ' LYS . 10.5 ptmm? -69.62 -26.83 64.62 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.846 0.355 . . . . 73.109999999999999 110.218 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -53.01 -51.35 61.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.64 -0.709 . . . . 71.530000000000001 110.579 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.585 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.0 mt-30 -83.7 -46.69 12.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.561 -0.745 . . . . 72.400000000000006 110.344 -178.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.633 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.6 ttt -56.35 -41.74 76.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.458 -0.792 . . . . 72.310000000000002 111.829 -175.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.622 ' HB2' HG21 ' A' ' 85' ' ' ILE . 28.7 tt0 -69.59 -36.41 76.2 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.673 0.273 . . . . 73.519999999999996 110.989 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.68 -6.22 51.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.345 0.593 . . . . 55.420000000000002 110.495 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.669 ' HE3' ' CE2' ' B' ' 252' ' ' PHE . 70.6 mmtt -99.03 -2.33 37.48 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.531 -0.759 . . . . 74.010000000000005 110.944 -177.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.708 ' HG3' ' H ' ' B' ' 263' ' ' GLN . 11.6 ptpt -50.73 -50.77 54.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.853 -0.612 . . . . 71.200000000000003 110.546 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.708 ' H ' ' HG3' ' B' ' 262' ' ' LYS . 12.5 tp60 -79.47 -22.14 44.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 116.145 -0.48 . . . . 72.040000000000006 110.533 -176.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.55 -30.8 37.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.239 -0.437 . . . . 75.450000000000003 111.408 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.49 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 24.0 ptp -83.75 -31.49 25.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.648 -0.871 . . . . 72.519999999999996 108.648 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.805 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 59.2 mtp -82.64 -3.37 56.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.259 -0.882 . . . . 73.219999999999999 110.442 176.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.44 -42.73 98.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.132 -0.486 . . . . 74.25 110.629 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.647 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 21.0 p90 -105.63 -9.04 17.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.865 -0.607 . . . . 70.120000000000005 111.079 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.557 ' O ' ' HE2' ' A' ' 37' ' ' MET . 3.5 m-30 -55.41 -51.13 67.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 O-C-N 123.074 0.233 . . . . 72.420000000000002 110.785 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.53 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -50.44 -58.5 5.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.893 -0.594 . . . . 74.010000000000005 110.74 176.73 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . 0.451 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 19.6 t70 -87.2 63.69 7.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.658 -0.701 . . . . 72.420000000000002 111.108 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.647 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 4.9 mmp_? -121.97 -45.66 2.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.111 -0.495 . . . . 74.519999999999996 111.284 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.721 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -92.03 13.28 19.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.3 . . . . 74.040000000000006 110.515 -174.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.6 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.0 ttmt -59.3 -54.31 48.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 65.120000000000005 110.84 -178.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -59.97 -41.56 92.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.397 -0.365 . . . . 70.109999999999999 111.41 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.18 -47.97 83.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.385 0.612 . . . . 74.109999999999999 109.963 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.547 HD21 ' HE3' ' A' ' 70' ' ' MET . 41.5 tp -63.18 -36.65 84.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.875 -1.057 . . . . 75.420000000000002 110.504 -178.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.477 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 9.1 t70 -63.71 -42.08 98.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.73 -0.668 . . . . 70.140000000000001 110.458 177.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -76.33 -14.99 60.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.649 -0.705 . . . . 55.130000000000003 111.324 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -94.85 -2.82 50.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.061 0.457 . . . . 74.239999999999995 110.72 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 19.0 mmt -89.49 179.77 5.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.883 -0.599 . . . . 73.540000000000006 110.684 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.685 ' HG2' HD11 ' B' ' 285' ' ' ILE . 42.1 mt-10 69.2 7.13 6.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.292 1.219 . . . . 63.450000000000003 114.292 166.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -64.78 -51.35 62.69 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.969 0.414 . . . . 72.329999999999998 110.297 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -77.14 -23.61 51.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.262 -0.426 . . . . 75.340000000000003 110.477 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.685 HD11 ' HG2' ' B' ' 282' ' ' GLU . 68.5 mt -65.19 -53.19 43.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.936 -0.574 . . . . 70.349999999999994 110.862 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 11.3 pt-20 -67.49 -20.96 65.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.319999999999993 111.78 -178.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . 0.406 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 51.5 m-80 -106.54 5.59 29.3 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.778 0.288 . . . . 72.400000000000006 111.778 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.88 -47.42 80.5 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.116 -0.234 . . . . 72.140000000000001 111.187 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.7 -25.26 66.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.149 -0.478 . . . . 71.099999999999994 111.013 -178.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -76.73 -54.9 6.02 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.952 -0.388 . . . . 71.120000000000005 109.952 176.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -59.44 -50.37 74.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.279 -0.419 . . . . 73.430000000000007 111.161 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.492 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 3.1 tmm_? -58.68 -29.48 66.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.412 -0.813 . . . . 74.329999999999998 110.215 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -81.17 -41.57 22.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.091 -0.504 . . . . 74.310000000000002 110.883 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 25.1 p -71.86 -18.34 62.07 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.184 0.439 . . . . 74.540000000000006 112.184 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -98.32 141.99 30.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.462 0.649 . . . . 71.299999999999997 110.939 -178.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 57.2 mttp . . . . . 0 C--O 1.248 0.991 0 CA-C-N 115.095 -0.957 . . . . 75.010000000000005 109.671 177.39 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.4 m . . . . . 0 N--CA 1.478 0.975 0 CA-C-O 120.595 0.236 . . . . 71.230000000000004 110.735 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -79.63 -33.82 41.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.919 0.39 . . . . 63.240000000000002 110.453 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.684 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.0 p-10 -150.7 120.53 7.08 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.018 -0.734 . . . . 74.340000000000003 109.018 172.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -78.79 -80.27 0.12 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.173 -0.467 . . . . 74.230000000000004 112.011 -171.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -98.78 -21.31 16.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.356 0.598 . . . . 74.530000000000001 110.768 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.684 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -133.16 -179.75 5.69 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.792 -0.64 . . . . 62.229999999999997 111.46 -173.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.436 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -83.67 46.13 1.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.334 -0.848 . . . . 70.310000000000002 111.871 -176.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -55.42 -41.13 72.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.772 0.32 . . . . 71.010000000000005 111.55 -176.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.39 -13.41 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 54.350000000000001 111.878 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 41.4 mmt180 -93.32 -60.34 1.81 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.765 -0.198 . . . . 73.040000000000006 110.627 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -54.31 -22.44 12.02 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.805 0.669 . . . . 73.120000000000005 112.805 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.578 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.7 t -68.37 -22.41 64.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.678 0.275 . . . . 71.25 110.768 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HB2' HD12 ' B' ' 217' ' ' LEU . 41.3 mt-10 -81.04 -27.61 35.69 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.319 0.58 . . . . 74.430000000000007 109.631 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.74 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -70.36 -48.53 55.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.205 -0.907 . . . . 72.109999999999999 109.724 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.481 HG13 ' HB3' ' B' ' 239' ' ' ALA . 80.6 mt -66.53 -27.86 41.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.469 0.652 . . . . 74.450000000000003 109.91 175.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.1 OUTLIER -66.74 -29.07 68.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.448 -0.796 . . . . 74.430000000000007 110.743 -177.362 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.634 HD11 HD12 ' B' ' 214' ' ' LEU . 2.8 tm? -75.25 -36.67 61.25 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.329 -0.619 . . . . 71.450000000000003 109.329 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.16 -28.45 70.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.801 -0.636 . . . . 64.409999999999997 110.462 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -76.9 -19.27 57.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.941 -0.572 . . . . 72.219999999999999 110.263 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.501 HE21 ' HD2' ' A' ' 16' ' ' LYS . 76.0 mm-40 -73.02 -41.82 63.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.68 -0.691 . . . . 71.409999999999997 109.474 176.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -78.93 -19.88 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.31 -0.859 . . . . 75.329999999999998 110.034 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.41 -5.86 53.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.663 -0.699 . . . . 74.239999999999995 110.128 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -75.55 -9.77 58.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.24 -0.436 . . . . 74.200000000000003 110.607 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.479 HD21 HG13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -78.64 111.48 14.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 72.439999999999998 109.726 178.579 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.438 ' H ' HG23 ' A' ' 25' ' ' THR . 2.9 t -73.37 -27.28 61.39 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.809 -0.632 . . . . 74.400000000000006 112.018 -174.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.26 -3.39 59.04 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.494 0.553 . . . . 64.219999999999999 112.494 -177.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.479 HG13 HD21 ' A' ' 24' ' ' ASN . 7.1 mt -107.45 149.51 10.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.806 -0.442 . . . . 74.329999999999998 109.806 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.08 145.06 32.63 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.16 -0.681 . . . . 72.099999999999994 109.16 177.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.523 HG23 ' HZ ' ' B' ' 247' ' ' PHE . 6.6 m -60.35 -25.11 65.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.203 0.525 . . . . 71.340000000000003 110.382 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.66 -15.74 71.3 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.691 -0.686 . . . . 73.209999999999994 112.884 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -81.28 -31.94 33.45 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.367 -0.605 . . . . 74.239999999999995 109.367 176.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -72.36 -44.78 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.467 -0.788 . . . . 74.409999999999997 110.443 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.0 p -60.91 -39.37 89.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.181 0.515 . . . . 71.409999999999997 110.471 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.56 72.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 74.310000000000002 110.788 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.413 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 51.6 m -67.96 -37.27 81.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.769 0.318 . . . . 75.310000000000002 110.159 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.55 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.1 t80 -68.24 -36.18 79.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.105 -0.702 . . . . 75.230000000000004 109.105 175.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.637 ' HE2' ' O ' ' B' ' 269' ' ' TYR . 10.3 tpt -60.18 -60.75 3.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.919 -1.037 . . . . 73.219999999999999 110.974 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.486 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 30.7 t-105 -59.52 -33.68 71.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.477 -0.783 . . . . 73.340000000000003 111.428 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.433 ' HB3' HG13 ' B' ' 215' ' ' ILE . . . -66.0 -41.52 90.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 64.109999999999999 111.586 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.589 HD12 ' HB3' ' B' ' 236' ' ' PHE . 50.3 tp -67.35 -33.1 74.53 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.983 0.42 . . . . 74.540000000000006 110.482 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.482 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -62.2 -40.12 95.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 40.140000000000001 110.839 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 42' ' ' ARG . 38.2 mtp85 -74.74 -34.8 62.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.804 -0.634 . . . . 74.329999999999998 110.823 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.509 ' HD2' HG22 ' B' ' 215' ' ' ILE . 9.9 t80 -76.53 -35.38 58.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 74.450000000000003 110.739 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -75.1 -34.95 61.78 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 111.807 0.299 . . . . 74.400000000000006 111.807 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.455 ' HA ' ' CE ' ' B' ' 281' ' ' MET . . . -68.47 -14.87 63.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.974 0.416 . . . . 75.5 111.361 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -58.11 -32.72 68.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.764 -0.653 . . . . 72.439999999999998 110.323 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.563 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 78.1 m-85 -80.38 -7.74 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.902 -0.59 . . . . 63.140000000000001 111.917 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.504 ' C ' ' HE3' ' A' ' 58' ' ' MET . . . -58.89 -34.93 80.47 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.452 -0.88 . . . . 64.400000000000006 111.779 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.1 t -72.79 -19.55 61.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.734 0.302 . . . . 71.510000000000005 111.087 -178.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 p -89.72 -14.21 35.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.783 0.325 . . . . 73.400000000000006 110.877 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.1 m -70.91 -32.49 69.44 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.258 -0.428 . . . . 75.150000000000006 111.951 -174.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -179.15 7.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.116 0.484 . . . . 74.430000000000007 111.537 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -99.77 -47.98 4.87 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.083 -0.962 . . . . 75.409999999999997 111.097 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.2 p -99.7 159.1 15.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.691 -0.231 . . . . 75.530000000000001 110.596 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -68.1 -34.95 77.35 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.083 0.24 . . . . 74.409999999999997 111.14 -175.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.31 -47.49 82.02 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.972 0.415 . . . . 73.319999999999993 110.53 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.579 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -75.43 -32.73 60.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 62.219999999999999 110.314 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.504 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 16.1 ttt -66.26 -45.7 79.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.021 -0.536 . . . . 73.549999999999997 110.782 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.43 ' HB2' HG21 ' B' ' 285' ' ' ILE . 34.0 tt0 -67.15 -29.82 69.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.815 -0.63 . . . . 73.120000000000005 110.753 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.84 -4.11 26.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.379 -0.373 . . . . 60.119999999999997 111.692 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.3 mmmm -117.67 4.66 12.32 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 120.75 0.31 . . . . 75.209999999999994 110.491 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.476 ' HA ' ' CE ' ' A' ' 65' ' ' MET . 16.3 ptmt -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.9 -0.591 . . . . 73.540000000000006 110.736 -174.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.4 tp60 -68.75 -26.08 65.06 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.87 0.367 . . . . 75.120000000000005 110.559 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.76 -42.97 69.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.974 -0.557 . . . . 65.510000000000005 111.644 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.476 ' CE ' ' HA ' ' A' ' 62' ' ' LYS . 2.8 ptt? -83.75 -27.08 29.15 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.17 -0.612 . . . . 72.400000000000006 109.782 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.616 ' HG2' HD23 ' B' ' 277' ' ' LEU . 75.7 mtp -78.47 -17.79 55.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.628 -0.715 . . . . 75.420000000000002 111.575 -178.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.44 -24.75 66.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.525 -0.917 . . . . 73.299999999999997 108.525 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.536 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 34.7 m-85 -93.71 -32.96 13.82 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 114.414 -1.266 . . . . 74.010000000000005 111.199 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.426 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 23.1 m-85 -60.98 -45.13 96.01 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.204 -0.665 . . . . 71.049999999999997 109.204 175.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.475 ' N ' ' HE1' ' A' ' 70' ' ' MET . 0.0 OUTLIER -67.04 -59.83 3.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.375 -0.375 . . . . 72.310000000000002 110.039 169.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -106.34 81.54 1.62 Allowed 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 113.189 0.811 . . . . 74.540000000000006 113.189 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.536 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 7.9 mmm180 -147.13 -31.16 0.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.731 -0.668 . . . . 72.230000000000004 109.757 164.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.614 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -93.08 10.87 29.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.309 -0.626 . . . . 71.319999999999993 109.309 178.148 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -66.36 -56.32 11.67 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.271 -0.877 . . . . 73.150000000000006 110.076 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.62 -36.81 77.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.477 -0.329 . . . . 64.409999999999997 110.925 177.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.0 mtt -62.67 -41.08 98.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.238 0.542 . . . . 74.010000000000005 110.05 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.589 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.2 tt -71.89 -42.11 67.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.486 -0.779 . . . . 73.400000000000006 110.144 -176.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.74 -39.85 82.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.26 0.553 . . . . 54.210000000000001 109.948 175.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.45 -21.22 66.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.324 -0.853 . . . . 72.129999999999995 111.365 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -93.36 -24.04 18.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 70.439999999999998 110.25 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.423 ' C ' ' H ' ' A' ' 83' ' ' ASP . 25.4 mmt -63.2 -45.59 91.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.523 -0.917 . . . . 73.109999999999999 108.523 169.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 43.4 mm-40 -68.21 12.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.24 -0.891 . . . . 75.230000000000004 111.916 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.423 ' H ' ' C ' ' A' ' 81' ' ' MET . 10.3 t70 -93.01 -55.5 3.32 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.902 -0.777 . . . . 75.439999999999998 108.902 172.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.785 -0.643 . . . . 73.349999999999994 111.808 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.7 mt -62.3 -57.39 12.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.491 0.186 . . . . 73.030000000000001 111.433 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.7 pt-20 -69.18 -15.74 63.47 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.125 0.417 . . . . 60.219999999999999 112.125 -175.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -109.13 10.3 25.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.998 -0.281 . . . . 75.120000000000005 110.942 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.507 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 71.5 t80 -57.87 -47.93 81.3 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.451 -0.34 . . . . 72.299999999999997 111.106 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.72 -27.72 69.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.384 -0.371 . . . . 72.310000000000002 110.443 -177.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -69.76 -51.83 30.61 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.696 -0.483 . . . . 74.409999999999997 109.696 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.557 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 73.1 m-85 -61.47 -44.99 96.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.297 0.57 . . . . 74.230000000000004 110.432 176.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.468 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 3.7 tmm_? -62.03 -22.63 65.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.415 -0.811 . . . . 73.299999999999997 110.128 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -82.45 -26.17 32.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.018 -0.537 . . . . 74.519999999999996 111.083 -178.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 p -90.37 -9.27 48.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.264 -0.426 . . . . 64.109999999999999 111.381 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.557 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 26.1 mt-30 -84.9 155.59 21.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.095 0.474 . . . . 71.319999999999993 111.038 -178.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 97.7 mttt . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.358 -0.837 . . . . 75.510000000000005 110.291 179.689 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.351 0.596 . . . . 72.239999999999995 110.274 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . 0.42 ' HB3' ' HB1' ' B' ' 209' ' ' ALA . 16.2 m120 -93.3 -11.14 33.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.632 -0.713 . . . . 72.329999999999998 110.127 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.755 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 0.5 OUTLIER -157.95 146.36 18.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.725 -0.67 . . . . 73.420000000000002 109.822 177.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -91.05 -75.85 0.46 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.095 -0.706 . . . . 71.109999999999999 109.095 178.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -115.5 -37.38 4.02 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.52 -0.919 . . . . 75.230000000000004 108.52 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.755 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -93.99 150.97 19.88 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.162 -0.926 . . . . 73.049999999999997 111.764 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.465 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -71.68 57.89 0.3 Allowed 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 125.064 1.346 . . . . 75.239999999999995 113.146 -179.639 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -51.67 -43.06 62.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.479 0.548 . . . . 75.420000000000002 112.479 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . 0.42 ' HB1' ' HB3' ' B' ' 202' ' ' ASN . . . -62.25 -27.76 69.23 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.946 0.721 . . . . 74.349999999999994 112.946 -174.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 19.5 mmt180 -87.66 -56.49 3.33 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.939 -0.304 . . . . 72.129999999999995 111.642 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -51.75 -25.73 8.1 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.689 0.626 . . . . 73.129999999999995 112.689 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 212' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 6.2 t -69.32 -23.63 63.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 121.336 -0.146 . . . . 62.299999999999997 111.357 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -81.71 -27.87 33.7 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.1 -0.704 . . . . 72.310000000000002 109.1 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.634 HD12 HD11 ' A' ' 17' ' ' LEU . 3.4 mm? -67.08 -51.78 50.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.78 -1.1 . . . . 73.310000000000002 109.467 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.509 HG22 ' HD2' ' A' ' 43' ' ' TYR . 78.1 mt -63.67 -30.37 49.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.515 -0.766 . . . . 75.540000000000006 110.227 176.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.487 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.0 OUTLIER -59.62 -36.98 77.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.8 -0.636 . . . . 70.319999999999993 110.82 -177.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.604 ' HA ' ' NE2' ' B' ' 220' ' ' GLN . 3.0 tm? -67.61 -40.01 84.74 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.128 -0.693 . . . . 74.439999999999998 109.128 178.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.16 66.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.716 -0.675 . . . . 72.349999999999994 110.707 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.56 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -66.28 -42.06 88.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.781 -0.645 . . . . 74.150000000000006 110.488 176.928 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . 0.604 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -61.78 -43.85 98.04 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.834 0.349 . . . . 74.430000000000007 111.158 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -70.16 -21.6 63.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.201 0.524 . . . . 74.140000000000001 110.379 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.51 -13.38 59.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.687 -0.688 . . . . 74.540000000000006 109.891 177.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 20.3 mm-40 -83.77 -2.07 55.55 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.318 -0.401 . . . . 75.200000000000003 110.218 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.557 HD21 HG13 ' B' ' 227' ' ' ILE . 1.4 t30 -81.46 103.26 11.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.114 -0.698 . . . . 72.549999999999997 109.114 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.1 t -59.25 -28.77 67.01 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 113.412 0.893 . . . . 74.040000000000006 113.412 -171.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -87.22 -0.29 56.48 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.931 0.345 . . . . 74.329999999999998 111.931 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.557 HG13 HD21 ' B' ' 224' ' ' ASN . 5.7 mt -112.24 149.49 14.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.866 -0.42 . . . . 65.129999999999995 109.866 177.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.457 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 0.3 OUTLIER -88.81 151.41 22.4 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.308 -0.627 . . . . 74.040000000000006 109.308 178.723 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.8 m -57.51 -30.83 65.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.262 0.554 . . . . 64.209999999999994 110.202 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.563 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.8 -16.14 74.22 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.461 -0.79 . . . . 72.209999999999994 113.645 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.457 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 7.7 mm-40 -87.79 -24.98 23.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.552 0.676 . . . . 74.319999999999993 109.642 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.13 -40.4 44.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 73.109999999999999 110.242 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.7 p -63.15 -39.04 93.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.202 0.525 . . . . 73.349999999999994 110.271 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.9 -32.99 74.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.751 -0.659 . . . . 64.329999999999998 110.837 178.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 46.8 m -66.73 -37.37 84.53 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.105 0.478 . . . . 72.409999999999997 110.101 178.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.589 ' HB3' HD12 ' A' ' 40' ' ' LEU . 4.4 t80 -67.76 -35.67 79.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 73.340000000000003 109.696 177.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.614 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.3 ttm -67.06 -50.26 62.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.685 -0.689 . . . . 63.329999999999998 111.489 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -59.49 -38.79 81.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.073 0.463 . . . . 75.120000000000005 110.728 178.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.481 ' HB3' HG13 ' A' ' 15' ' ' ILE . . . -66.09 -41.07 91.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.01 -0.541 . . . . 74.439999999999998 111.443 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.58 HD21 ' SD ' ' A' ' 37' ' ' MET . 53.1 tp -65.67 -33.71 76.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.893 0.378 . . . . 74.340000000000003 110.557 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.2 -40.53 97.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 71.430000000000007 110.773 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.8 mtp85 -70.7 -42.15 71.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.061 -0.518 . . . . 72.340000000000003 110.604 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -70.6 -37.96 73.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.79 -0.641 . . . . 75.299999999999997 111.179 -174.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -71.83 -34.79 69.6 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.964 0.357 . . . . 73.129999999999995 111.964 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -65.74 -25.69 67.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 64.5 111.153 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -59.56 -33.84 71.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.637 -0.71 . . . . 75.200000000000003 110.113 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.523 ' HZ ' HG23 ' A' ' 29' ' ' THR . 71.5 m-85 -83.68 -8.71 59.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.31 -0.405 . . . . 73.209999999999994 111.33 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.494 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -73.56 -30.94 61.38 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.23 -0.986 . . . . 64.329999999999998 110.661 171.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 34.9 t -70.12 -12.25 61.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.299 -0.451 . . . . 62.240000000000002 111.141 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.1 t -113.61 14.07 18.82 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.041 0.448 . . . . 75.150000000000006 110.27 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 29.0 t -88.95 -35.65 16.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.163 -0.472 . . . . 72.420000000000002 110.641 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.485 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.5 OUTLIER -137.95 174.01 11.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.761 0.315 . . . . 75.019999999999996 111.579 178.895 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -92.87 -30.61 15.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.773 -0.649 . . . . 75.549999999999997 112.325 -170.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.2 p -120.58 156.12 32.27 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.811 -0.177 . . . . 65.430000000000007 110.63 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.507 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 12.6 ptmm? -64.33 -29.11 70.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 74.219999999999999 110.37 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . 0.477 ' OE2' ' HG3' ' B' ' 255' ' ' LYS . 19.9 mm-40 -63.4 -57.58 9.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 75.430000000000007 110.651 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.682 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 22.2 mt-30 -68.94 -39.09 79.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.968 -0.56 . . . . 74.540000000000006 110.651 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.454 ' HE1' ' C ' ' B' ' 248' ' ' GLY . 10.2 ttt -60.41 -44.08 96.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.285 -0.416 . . . . 75.099999999999994 110.883 179.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.514 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 7.8 tt0 -62.79 -35.78 80.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.089 0.471 . . . . 74.549999999999997 110.835 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -74.07 -5.81 43.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.006 -0.543 . . . . 64.230000000000004 111.094 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.682 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 14.3 mmmm -114.3 6.79 16.24 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.509 -0.314 . . . . 74.239999999999995 110.448 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.552 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 17.8 ptpt -56.95 -53.2 60.75 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 120.678 -0.409 . . . . 75.439999999999998 110.226 -177.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.552 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 15.0 tp60 -72.45 -22.01 61.15 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.847 -0.427 . . . . 72.140000000000001 109.847 -177.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -69.91 -42.44 73.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.6 -0.727 . . . . 71.25 111.299 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.494 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 2.6 ptt? -88.13 -27.7 21.74 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.211 0.529 . . . . 73.129999999999995 109.97 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.589 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 80.6 mtp -74.58 -17.51 60.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.684 -0.689 . . . . 75.340000000000003 110.611 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -62.37 -30.12 70.96 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.92 -0.77 . . . . 74.109999999999999 108.92 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.551 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.7 m-85 -86.7 -35.38 19.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.483 -1.235 . . . . 72.409999999999997 111.157 178.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.637 ' O ' ' HE2' ' A' ' 37' ' ' MET . 22.6 m-30 -61.09 -44.29 97.59 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.485 -0.561 . . . . 73.230000000000004 109.485 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.421 ' HE2' ' N ' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.55 -57.3 5.38 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.352 -0.539 . . . . 73.010000000000005 109.679 171.256 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . 0.51 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 7.0 t70 -108.53 81.42 1.47 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.657 0.614 . . . . 74.230000000000004 112.657 -172.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.551 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 5.8 mmm180 -156.81 -26.81 0.09 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.945 -0.57 . . . . 74.049999999999997 110.029 166.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.457 ' HB3' ' HE3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -95.27 9.32 40.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.469 -0.937 . . . . 74.540000000000006 108.469 174.191 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.446 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 62.1 tttm -64.29 -59.32 4.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.248 -1.342 . . . . 74.299999999999997 110.356 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -55.3 -38.86 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 74.409999999999997 111.013 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 276' ' ' MET . . . . . 0.486 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 50.2 mtt -60.63 -40.99 93.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.447 0.641 . . . . 73.430000000000007 110.412 177.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.616 HD23 ' HG2' ' A' ' 66' ' ' MET . 0.9 OUTLIER -75.01 -41.34 59.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.283 -0.871 . . . . 75.439999999999998 110.274 -178.006 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.574 ' HB2' ' HE1' ' A' ' 66' ' ' MET . 9.4 t70 -57.87 -44.53 86.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 74.010000000000005 110.242 178.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.47 69.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.127 -0.942 . . . . 74.120000000000005 111.748 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -83.57 -21.49 32.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.9 0.381 . . . . 74.400000000000006 110.528 -178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.455 ' CE ' ' HA ' ' A' ' 45' ' ' ALA . 24.3 mmt -68.26 -52.97 27.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.038 -0.528 . . . . 72.430000000000007 110.14 175.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.684 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 40.1 mm-40 -51.08 -37.56 46.43 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.319 -0.855 . . . . 73.099999999999994 112.338 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -50.0 -42.75 49.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.697 0.284 . . . . 62.130000000000003 111.676 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -86.86 -32.16 20.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.857 0.36 . . . . 74.010000000000005 110.595 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.455 HG13 ' O ' ' B' ' 281' ' ' MET . 70.5 mt -66.28 -55.31 19.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.935 -0.575 . . . . 74.140000000000001 111.521 -177.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.684 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -75.08 -6.58 50.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 72.430000000000007 111.758 -175.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -116.37 12.37 15.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.328 -0.396 . . . . 75.530000000000001 110.857 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -53.0 -49.23 66.61 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.192 0.307 . . . . 74.099999999999994 111.037 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -57.32 -35.14 69.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.862 -0.608 . . . . 72.109999999999999 111.134 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -70.91 -50.86 30.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 74.310000000000002 109.975 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . 0.612 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 65.2 m-85 -57.84 -50.77 72.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.993 -0.549 . . . . 73.540000000000006 110.758 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -22.16 62.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.281 0.562 . . . . 74.239999999999995 110.421 -178.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -82.56 -36.24 26.44 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.017 -0.538 . . . . 65.140000000000001 110.752 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 18.0 p -85.25 -17.99 35.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.997 -0.547 . . . . 73.140000000000001 111.652 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.612 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 25.5 mt-30 -84.63 163.87 19.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.251 0.548 . . . . 75.400000000000006 110.858 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 92.1 mttt . . . . . 0 C--O 1.249 1.074 0 CA-C-N 115.224 -0.898 . . . . 73.530000000000001 109.133 179.574 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 110.366 -0.235 . . . . 73.099999999999994 110.366 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -93.52 15.03 16.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.647 0.737 . . . . 74.010000000000005 109.294 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.5 p-10 -158.79 152.91 23.72 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.305 -0.861 . . . . 75.340000000000003 109.612 -178.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -81.77 -81.66 0.14 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.762 0.315 . . . . 75.439999999999998 110.967 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -111.16 -33.13 6.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.899 0.381 . . . . 74.120000000000005 110.875 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -104.76 159.64 15.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.081 0.467 . . . . 73.420000000000002 111.363 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.482 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.1 OUTLIER -76.78 53.66 0.93 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.164 -0.925 . . . . 74.540000000000006 112.481 -177.531 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.416 ' CE1' ' HB1' ' A' ' 6' ' ' ALA . 37.8 m-85 -54.39 -38.99 66.81 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.862 0.363 . . . . 71.109999999999999 111.253 -178.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.44 -14.36 60.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.814 -0.63 . . . . 74.310000000000002 112.207 -176.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.613 ' NH1' ' HB3' ' B' ' 231' ' ' GLU . 64.5 mtt180 -93.5 -59.98 1.88 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.051 -0.352 . . . . 74.430000000000007 110.051 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.47 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.83 -25.94 21.92 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.766 -0.652 . . . . 71.430000000000007 112.657 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.5 t -63.95 -22.9 67.13 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.634 0.254 . . . . 61.229999999999997 111.296 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.502 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.9 mt-10 -90.98 -32.25 16.02 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.913 0.387 . . . . 74.349999999999994 109.969 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.598 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.6 mm? -61.92 -45.96 91.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.157 -0.683 . . . . 73.129999999999995 109.157 176.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.573 HG21 ' HD2' ' B' ' 243' ' ' TYR . 92.3 mt -66.86 -28.42 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.404 -0.817 . . . . 64.310000000000002 110.399 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.2 OUTLIER -68.49 -29.91 68.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.857 -0.61 . . . . 73.109999999999999 110.575 -177.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.485 HD11 HD12 ' B' ' 214' ' ' LEU . 2.2 tm? -69.86 -44.63 69.45 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.69 -0.856 . . . . 75.230000000000004 108.69 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.85 -33.1 74.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.374 -0.83 . . . . 64.439999999999998 109.965 178.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.578 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 5.4 t-20 -57.23 -38.7 74.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.221 -0.9 . . . . 72.319999999999993 110.396 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -67.01 -42.17 85.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 73.319999999999993 111.368 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -74.26 -20.32 60.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.053 0.454 . . . . 74.140000000000001 110.53 -177.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -88.04 0.21 56.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 70.010000000000005 110.68 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.578 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.9 mm-40 -80.77 55.23 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.868 0.366 . . . . 62.420000000000002 110.467 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.509 ' ND2' HG13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -144.62 142.48 30.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 74.349999999999994 109.873 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.5 t -93.18 -43.36 8.89 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.291 0.478 . . . . 71.329999999999998 112.291 -176.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -73.7 -24.75 59.98 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.382 0.512 . . . . 75.450000000000003 112.382 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.509 HG13 ' ND2' ' A' ' 24' ' ' ASN . 5.6 mt -83.76 143.98 10.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.296 -0.631 . . . . 73.510000000000005 109.296 177.192 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.609 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -83.42 150.68 25.9 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.997 -0.547 . . . . 60.030000000000001 110.017 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 m -56.37 -33.28 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.657 -0.702 . . . . 73.019999999999996 111.375 -175.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.578 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -63.14 -26.53 69.33 Favored Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.945 -0.57 . . . . 42.439999999999998 113.997 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.609 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 51.8 mm-40 -62.97 -28.43 70.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 117.318 0.559 . . . . 72.400000000000006 111.172 -176.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.67 -46.78 15.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 73.510000000000005 110.825 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 m -55.7 -40.11 71.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 63.130000000000003 110.983 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.78 68.37 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.14 -0.482 . . . . 64.299999999999997 111.229 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.5 m -66.9 -32.08 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 74.420000000000002 110.107 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.598 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.5 t80 -68.45 -33.11 73.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.872 -0.604 . . . . 74.409999999999997 109.854 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.549 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.5 ttm -68.09 -49.72 59.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 74.510000000000005 111.407 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.477 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 29.3 t-105 -62.02 -37.59 85.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.076 0.465 . . . . 73.25 110.669 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.42 -34.32 76.98 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 70.420000000000002 111.264 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.4 tp -65.64 -35.71 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 120.942 0.401 . . . . 74.230000000000004 110.029 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.511 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -62.11 -54.18 44.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.876 -0.602 . . . . 73.040000000000006 110.985 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -61.9 -32.82 73.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.644 -0.253 . . . . 75.230000000000004 111.602 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -77.4 -39.33 47.49 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.972 -0.291 . . . . 73.0 110.917 -177.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -70.31 -35.41 73.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 75.150000000000006 110.806 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.416 ' HB3' ' HG2' ' B' ' 281' ' ' MET . . . -69.54 -11.53 60.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.488 . . . . 73.239999999999995 111.129 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 19.2 t90 -74.19 -15.28 61.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.444 0.64 . . . . 73.099999999999994 109.833 176.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -97.8 -0.93 44.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.998 0.428 . . . . 75.200000000000003 111.142 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.596 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -74.94 -29.84 60.26 Favored Glycine 0 N--CA 1.443 -0.841 0 C-N-CA 120.47 -0.872 . . . . 74.439999999999998 111.009 176.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.56 ' HA ' ' CE ' ' A' ' 58' ' ' MET . 7.0 p -73.15 -5.37 38.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.754 0.311 . . . . 73.299999999999997 111.826 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -120.19 14.01 12.11 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.428 . . . . 64.129999999999995 110.372 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -76.66 -54.93 5.99 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.163 -0.471 . . . . 64.239999999999995 111.884 -178.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.689 ' HE2' ' HE2' ' A' ' 61' ' ' LYS . 3.0 m-85 -128.87 173.55 10.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.034 0.445 . . . . 74.109999999999999 112.076 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.515 ' HG3' HG22 ' A' ' 54' ' ' THR . 12.1 pt-20 -88.51 -36.08 16.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.28 -0.873 . . . . 73.450000000000003 111.459 -172.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.515 HG22 ' HG3' ' A' ' 53' ' ' GLU . 62.9 p -119.85 151.53 38.72 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 116.105 -0.498 . . . . 74.540000000000006 110.283 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.565 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 21.2 ptmt -68.6 -25.07 64.68 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.652 -0.499 . . . . 74.439999999999998 109.652 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -55.2 -40.39 70.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.579 -0.737 . . . . 71.530000000000001 110.468 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.665 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 15.2 mt-30 -93.84 -43.32 8.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.623 -0.717 . . . . 72.420000000000002 110.311 178.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.64 ' HE3' HG13 ' B' ' 285' ' ' ILE . 24.5 ttt -58.11 -40.64 81.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.642 -0.708 . . . . 74.439999999999998 111.904 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.72 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.8 tt0 -64.38 -41.92 96.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.814 0.34 . . . . 73.450000000000003 110.633 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.56 -18.29 64.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.097 -0.502 . . . . 74.109999999999999 111.164 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.689 ' HE2' ' HE2' ' A' ' 52' ' ' PHE . 32.3 mmmt -91.28 0.35 57.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.11 -0.495 . . . . 73.340000000000003 110.54 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 ptmm? -55.15 -43.05 73.88 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.829 -0.434 . . . . 73.349999999999994 109.829 -177.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -82.76 -19.61 37.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.278 -0.419 . . . . 71.140000000000001 110.521 -178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.449 ' CD ' ' HZ1' ' A' ' 61' ' ' LYS . 44.0 mt-10 -87.17 -30.5 20.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.028 -0.533 . . . . 73.099999999999994 111.584 -175.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.423 ' HG3' ' HE3' ' B' ' 281' ' ' MET . 23.3 ptp -82.02 -27.52 33.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.189 -1.041 . . . . 73.239999999999995 108.189 177.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.512 ' HE2' ' HB2' ' B' ' 278' ' ' ASP . 77.8 mtp -85.97 -10.02 55.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.899 -1.046 . . . . 73.120000000000005 110.429 177.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -53.05 -43.55 66.72 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.724 -0.671 . . . . 72.5 111.791 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.565 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 6.6 p90 -109.69 -1.53 17.98 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.159 -0.473 . . . . 75.239999999999995 111.215 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.654 ' HD2' HD23 ' B' ' 277' ' ' LEU . 4.2 m-30 -63.0 -46.99 85.04 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.52 0.2 . . . . 73.530000000000001 110.759 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.451 ' HE1' HD21 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.1 -46.22 72.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.415 0.626 . . . . 75.219999999999999 110.042 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -89.65 14.07 12.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.089 -0.959 . . . . 75.409999999999997 112.172 -168.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.726 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -86.08 -43.05 13.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.584 -0.697 . . . . 73.319999999999993 111.443 -172.065 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.659 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -98.68 15.29 25.68 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.389 -0.524 . . . . 74.319999999999993 110.212 -178.347 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.573 ' HE3' ' HG2' ' B' ' 270' ' ' MET . 32.8 ttmt -62.86 -52.92 61.26 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.705 -0.68 . . . . 72.129999999999995 109.576 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -57.49 -41.41 80.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.137 -0.938 . . . . 74.109999999999999 111.135 177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -61.16 -47.32 86.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.262 0.554 . . . . 73.200000000000003 110.592 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.86 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.0 OUTLIER -69.66 -36.09 75.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.245 -0.889 . . . . 74.219999999999999 110.63 -174.551 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -61.12 -31.2 70.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.237 0.542 . . . . 75.329999999999998 110.532 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.9 59.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.602 -0.726 . . . . 72.340000000000003 111.524 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -105.46 -16.57 14.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.057 0.456 . . . . 75.409999999999997 110.662 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.429 ' HE3' ' CD2' ' A' ' 77' ' ' LEU . 20.9 mmt -75.97 -179.15 4.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.797 -0.638 . . . . 73.239999999999995 111.415 177.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.588 ' HA ' HD12 ' A' ' 85' ' ' ILE . 40.5 mt-10 67.8 8.74 6.63 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.878 -1.055 . . . . 72.209999999999994 113.718 171.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.29 -55.26 35.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.145 0.497 . . . . 74.129999999999995 110.648 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -85.24 -10.23 56.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.95 -0.568 . . . . 74.439999999999998 111.012 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.588 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -76.0 -57.33 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 120.757 0.313 . . . . 74.430000000000007 110.744 -178.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.0 pt-20 -66.8 -25.56 66.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.735 0.302 . . . . 74.120000000000005 110.872 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -99.0 7.26 46.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.337 -0.392 . . . . 65.150000000000006 111.304 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -60.02 -39.34 85.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.708 0.289 . . . . 73.239999999999995 110.466 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.95 -38.95 68.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.324 0.583 . . . . 70.140000000000001 110.478 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -68.6 -48.87 63.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.509 -0.769 . . . . 74.040000000000006 110.168 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -64.7 -32.17 73.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.928 0.394 . . . . 72.120000000000005 111.205 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -13.36 61.66 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.522 0.677 . . . . 65.329999999999998 110.094 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -97.28 -41.47 8.25 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.569 -0.741 . . . . 63.109999999999999 110.545 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 40.3 p -92.07 18.09 8.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.187 -0.46 . . . . 72.230000000000004 111.592 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -61.21 152.43 28.87 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.217 0.532 . . . . 72.510000000000005 111.072 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.403 ' NZ ' ' HB2' ' A' ' 96' ' ' LYS . 8.0 mtmp? . . . . . 0 C--N 1.32 -0.712 0 CA-C-N 115.753 -0.658 . . . . 73.430000000000007 110.963 -173.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 21.2 m . . . . . 0 C--O 1.234 0.255 0 CA-C-O 120.98 0.419 . . . . 71.450000000000003 110.722 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -85.16 11.54 9.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.718 0.77 . . . . 72.439999999999998 109.8 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.681 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.4 OUTLIER -149.76 154.16 38.03 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.027 -0.988 . . . . 74.109999999999999 108.805 176.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.14 -79.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.799 0.333 . . . . 75.040000000000006 111.502 -176.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.41 -56.32 2.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.1 0.476 . . . . 74.329999999999998 110.112 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -71.28 160.39 32.89 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.757 -0.656 . . . . 72.120000000000005 110.642 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.477 ' HE1' ' CB ' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -76.62 52.26 0.8 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.598 -0.728 . . . . 73.230000000000004 112.251 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.681 ' HD2' ' HB2' ' B' ' 203' ' ' ASN . 55.8 m-85 -55.62 -37.51 68.27 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.965 0.412 . . . . 73.349999999999994 111.179 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -70.49 -20.6 62.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.537 . . . . 74.099999999999994 111.689 -176.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.408 ' NH1' ' HB3' ' A' ' 31' ' ' GLU . 79.4 mtt180 -91.6 -60.6 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.83 0.348 . . . . 74.030000000000001 110.228 -177.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.738 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -56.7 -22.88 38.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.715 -0.675 . . . . 72.120000000000005 112.669 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 212' ' ' THR . . . . . 0.428 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -65.97 -24.82 66.87 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.591 0.234 . . . . 71.319999999999993 110.741 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 38.8 mt-10 -83.04 -25.94 31.64 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.423 0.63 . . . . 71.140000000000001 109.865 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.738 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.59 -42.84 91.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.351 -0.84 . . . . 71.420000000000002 109.512 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 79.6 mt -68.58 -26.53 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.629 -0.714 . . . . 75.120000000000005 110.221 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' B' ' 213' ' ' GLU . 10.6 mmmm -60.73 -42.27 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.056 -0.52 . . . . 75.239999999999995 111.66 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.547 ' O ' HD12 ' B' ' 217' ' ' LEU . 2.6 tm? -64.33 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.164 -0.68 . . . . 73.299999999999997 109.164 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -72.28 -37.55 68.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.777 -0.647 . . . . 74.329999999999998 109.979 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.641 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.2 m-20 -61.0 -34.28 74.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 73.129999999999995 110.689 176.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.07 -38.37 79.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 72.340000000000003 111.572 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -76.61 -22.61 53.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.348 0.594 . . . . 73.219999999999999 110.198 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -78.99 -13.28 59.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.261 -0.882 . . . . 74.510000000000005 110.714 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.641 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 84.8 mm-40 -72.3 -7.36 49.06 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.336 0.495 . . . . 74.109999999999999 112.336 -176.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.698 HD21 HG13 ' B' ' 227' ' ' ILE . 9.5 t30 -71.43 166.8 20.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 72.540000000000006 110.194 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.6 t -116.48 3.01 13.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.772 0.32 . . . . 75.319999999999993 111.43 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -128.93 7.08 5.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.023 0.379 . . . . 74.099999999999994 112.023 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.698 HG13 HD21 ' B' ' 224' ' ' ASN . 4.5 mt -109.9 144.45 18.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.284 -0.566 . . . . 75.219999999999999 110.118 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -79.4 142.26 36.13 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.162 -0.927 . . . . 71.049999999999997 109.066 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 39.3 m -60.2 -27.64 67.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.063 0.459 . . . . 75.409999999999997 110.649 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.85 -15.42 76.01 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.912 -0.585 . . . . 74.420000000000002 112.843 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.613 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 68.1 mm-40 -78.25 -18.22 55.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 117.194 0.497 . . . . 74.120000000000005 110.467 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.3 -38.25 10.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.669 -0.696 . . . . 75.040000000000006 110.497 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.1 p -64.4 -38.77 92.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.236 0.541 . . . . 71.400000000000006 110.347 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.12 -37.47 85.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.776 -0.647 . . . . 74.239999999999995 111.103 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.482 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 2.3 p -71.65 -26.41 62.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.97 -0.292 . . . . 65.230000000000004 110.748 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.533 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 6.9 t80 -70.28 -40.63 74.21 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.088 -0.708 . . . . 72.540000000000006 109.088 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.659 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.7 ttm -65.79 -47.87 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.48 -0.782 . . . . 74.439999999999998 111.344 178.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -60.92 -38.42 85.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.995 0.426 . . . . 74.349999999999994 110.701 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.48 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.2 -33.15 75.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 74.420000000000002 111.449 -178.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 36' ' ' PHE . 49.3 tp -70.05 -34.95 73.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.976 0.417 . . . . 75.120000000000005 109.891 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.48 -48.86 77.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.788 -0.642 . . . . 75.329999999999998 110.821 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -77.95 -14.9 59.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 63.310000000000002 111.028 -175.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.573 ' HD2' HG21 ' A' ' 15' ' ' ILE . 28.0 t80 -89.13 -48.91 7.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.222 0.534 . . . . 72.030000000000001 110.349 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -78.58 -16.38 57.48 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.846 -0.615 . . . . 73.150000000000006 112.015 -170.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -66.99 -15.42 63.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.147 0.499 . . . . 74.099999999999994 111.008 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -56.96 -31.74 65.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.443 -0.799 . . . . 73.329999999999998 111.506 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.578 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 67.9 m-85 -73.5 -11.64 60.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.316 -0.402 . . . . 73.209999999999994 112.0 -175.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.634 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -61.49 -38.42 95.76 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.15 -1.024 . . . . 74.010000000000005 111.384 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 249' ' ' SER . . . . . 0.472 ' HA ' ' CE ' ' B' ' 258' ' ' MET . 13.1 m -66.85 -13.17 61.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.057 0.392 . . . . 51.200000000000003 112.057 -175.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.8 t -116.81 18.29 14.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.072 0.463 . . . . 65.409999999999997 110.582 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 30.2 t -83.48 -49.24 9.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 75.239999999999995 111.568 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 1.6 m-85 -139.5 -179.45 5.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.653 0.612 . . . . 74.25 112.653 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.598 ' HG3' HG21 ' B' ' 254' ' ' THR . 15.5 pt-20 -92.13 -36.41 13.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.836 -1.074 . . . . 75.120000000000005 112.043 -171.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.598 HG21 ' HG3' ' B' ' 253' ' ' GLU . 69.8 p -123.17 154.92 38.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.328 -0.396 . . . . 72.109999999999999 110.181 -176.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -65.04 -29.78 70.71 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.154 0.284 . . . . 73.530000000000001 110.72 -178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -59.0 -53.03 63.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.281 0.562 . . . . 75.349999999999994 110.849 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.615 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.8 mt-30 -78.54 -35.3 46.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.663 -0.699 . . . . 73.409999999999997 110.361 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.634 ' HE2' ' O ' ' B' ' 248' ' ' GLY . 25.6 ttt -64.26 -42.86 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.895 -0.593 . . . . 72.219999999999999 111.105 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.45 -35.48 79.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 75.239999999999995 110.887 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.6 2.9 7.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.925 0.393 . . . . 70.540000000000006 111.459 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.615 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.7 mmmt -114.65 -0.16 13.71 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 109.895 -0.409 . . . . 75.340000000000003 109.895 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.448 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 9.9 ptmt -55.22 -52.17 64.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.84 -0.618 . . . . 61.149999999999999 110.942 -173.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.5 tp60 -76.72 -26.05 54.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 109.985 -0.376 . . . . 74.519999999999996 109.985 -177.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -75.05 -34.13 61.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.05 -0.523 . . . . 75.340000000000003 111.633 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 22.0 ptp -81.49 -29.26 33.73 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.372 -0.973 . . . . 75.409999999999997 108.372 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.86 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 68.0 mtp -80.86 -19.17 45.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.914 -1.039 . . . . 73.129999999999995 111.253 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -68.64 -27.32 65.9 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-O 122.079 0.942 . . . . 73.549999999999997 108.5 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -99.94 8.8 43.81 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.216 -1.356 . . . . 74.510000000000005 111.277 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.445 ' C ' ' HH ' ' A' ' 73' ' ' TYR . 22.4 m-30 -97.05 -45.93 6.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 106.951 -1.5 . . . . 75.209999999999994 106.951 165.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.573 ' HG2' ' HE3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -59.69 -66.05 0.58 Allowed 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.407 -0.815 . . . . 73.519999999999996 110.53 170.486 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . 0.573 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 4.8 t70 -102.03 76.5 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.101 0.408 . . . . 73.209999999999994 112.101 -171.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG2' ' O ' ' B' ' 271' ' ' ASP . 1.8 mmp_? -152.23 -28.92 0.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 75.349999999999994 111.383 170.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.549 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.62 1.44 42.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.525 -0.917 . . . . 74.310000000000002 108.525 174.613 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.48 -49.32 77.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.485 -1.234 . . . . 72.409999999999997 110.692 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.75 -42.65 99.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 73.120000000000005 110.866 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 54.3 mtt -61.55 -47.65 84.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.625 -0.716 . . . . 73.420000000000002 109.676 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.654 HD23 ' HD2' ' A' ' 69' ' ' TYR . 34.3 tp -59.9 -42.86 94.77 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.644 -1.162 . . . . 70.430000000000007 111.165 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.512 ' HB2' ' HE2' ' A' ' 66' ' ' MET . 15.1 t70 -61.94 -43.13 99.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.196 0.522 . . . . 73.209999999999994 110.14 178.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.04 -20.75 60.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.391 -0.822 . . . . 64.450000000000003 111.525 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -87.95 -9.51 53.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 74.299999999999997 110.634 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.429 ' HG3' ' O ' ' B' ' 277' ' ' LEU . 58.3 mtt -93.35 -169.23 2.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.104 -0.498 . . . . 75.319999999999993 111.07 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.76 ' HG2' HD11 ' B' ' 285' ' ' ILE . 38.4 mt-10 69.47 13.93 8.36 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.899 -1.046 . . . . 75.319999999999993 112.311 177.075 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -65.48 -47.03 77.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.958 0.409 . . . . 74.549999999999997 110.073 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . 0.446 ' O ' ' HB2' ' B' ' 288' ' ' PHE . 4.3 m-85 -89.45 -5.44 57.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.508 -0.315 . . . . 73.129999999999995 111.006 174.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.76 HD11 ' HG2' ' B' ' 282' ' ' GLU . 60.8 mt -79.54 -59.79 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 110.138 -0.319 . . . . 62.210000000000001 110.138 178.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 3.1 pt-20 -65.56 -27.89 68.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.867 0.365 . . . . 73.5 110.701 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -98.52 7.09 46.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.426 -0.352 . . . . 75.040000000000006 111.054 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.446 ' HB2' ' O ' ' B' ' 284' ' ' TYR . 76.9 t80 -64.35 -37.54 87.87 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.93 -0.767 . . . . 74.329999999999998 108.93 174.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -53.27 -32.16 47.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.414 -0.812 . . . . 72.329999999999998 110.252 173.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -78.47 -56.16 4.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.297 -0.865 . . . . 71.329999999999998 110.021 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -62.3 -39.26 92.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.231 -0.44 . . . . 75.230000000000004 111.91 -176.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 17.3 tpp180 -66.22 -19.05 65.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.122 0.487 . . . . 73.400000000000006 110.339 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -96.73 -23.01 16.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.283 -0.417 . . . . 64.239999999999995 111.504 -177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.9 p -111.12 18.68 19.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.13 0.49 . . . . 74.129999999999995 111.066 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -69.25 160.44 31.19 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.77 -0.65 . . . . 72.409999999999997 111.11 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . 0.654 ' HZ1' ' HB2' ' B' ' 296' ' ' LYS . 9.5 mtmp? . . . . . 0 C--N 1.318 -0.803 0 CA-C-N 115.251 -0.886 . . . . 75.120000000000005 109.166 177.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.592 0.234 . . . . 73.420000000000002 110.383 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 56.53 52.67 9.51 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.709 -0.678 . . . . 74.450000000000003 111.29 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.63 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.9 p-10 -157.52 132.68 8.87 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.973 -0.558 . . . . 71.030000000000001 110.769 178.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.79 -72.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.583 -0.735 . . . . 72.400000000000006 111.111 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -120.63 -57.59 1.89 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.196 -0.456 . . . . 74.219999999999999 109.822 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.29 161.94 28.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.871 -0.604 . . . . 75.140000000000001 110.981 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.53 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -79.72 54.85 1.9 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.384 -0.826 . . . . 71.120000000000005 111.948 -179.078 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -52.14 -45.29 64.94 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.379 -0.373 . . . . 74.299999999999997 111.962 -175.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.54 -10.57 58.67 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 112.441 0.534 . . . . 73.120000000000005 112.441 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 95.5 mtt180 -91.33 -62.07 1.52 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.901 -0.407 . . . . 74.340000000000003 109.901 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.73 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -55.28 -25.03 31.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.772 0.656 . . . . 71.319999999999993 112.772 -178.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.425 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 15.1 t -64.73 -20.81 66.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.147 -0.221 . . . . 75.030000000000001 111.321 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HB2' HD11 ' B' ' 217' ' ' LEU . 39.7 mt-10 -86.22 -30.81 22.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.423 -0.584 . . . . 73.5 109.423 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.73 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.68 -47.08 82.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.168 -0.924 . . . . 75.329999999999998 109.021 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.5 HG13 ' HB1' ' B' ' 239' ' ' ALA . 72.3 mt -67.16 -29.87 47.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.483 -0.781 . . . . 74.409999999999997 110.389 175.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 12' ' ' THR . 1.2 tmmt? -64.02 -32.31 73.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 71.239999999999995 110.475 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' A' ' 17' ' ' LEU . 1.6 tm? -69.33 -43.88 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.997 -0.742 . . . . 75.530000000000001 108.997 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.8 84.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.947 -0.569 . . . . 71.540000000000006 110.694 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.521 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 8.0 m-80 -59.4 -32.89 70.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.842 -0.617 . . . . 73.409999999999997 110.944 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -73.88 -31.82 63.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 65.120000000000005 111.53 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -84.73 -22.33 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.827 0.346 . . . . 72.209999999999994 111.023 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -83.6 -0.48 50.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.275 0.56 . . . . 73.430000000000007 110.088 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.2 mm-40 -75.69 -13.69 60.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 74.140000000000001 109.814 173.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.64 HD21 HG13 ' A' ' 27' ' ' ILE . 2.0 t30 -69.2 114.98 7.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.513 -0.767 . . . . 74.319999999999993 109.681 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -62.65 -34.54 77.29 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.405 0.891 . . . . 70.030000000000001 113.405 -170.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 pm0 -90.96 1.19 57.24 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.42 -0.512 . . . . 74.420000000000002 112.175 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.64 HG13 HD21 ' A' ' 24' ' ' ASN . 7.6 mt -104.09 149.46 7.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.423 0.63 . . . . 75.140000000000001 110.158 177.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.536 ' CG ' ' HG3' ' A' ' 31' ' ' GLU . 16.8 pt20 -90.46 155.74 18.7 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.104 -0.953 . . . . 74.319999999999993 109.143 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 m -60.73 -21.51 63.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.478 0.656 . . . . 65.439999999999998 110.259 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.441 ' HA2' ' CZ ' ' B' ' 247' ' ' PHE . . . -67.15 -39.85 92.63 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.38 -0.827 . . . . 73.329999999999998 113.283 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.536 ' HG3' ' CG ' ' A' ' 28' ' ' GLN . 42.8 mt-10 -67.85 -32.03 72.27 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 117.488 0.644 . . . . 75.239999999999995 110.317 -174.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -72.68 -41.37 62.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.565 -0.743 . . . . 74.329999999999998 110.385 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -61.83 -44.73 96.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.211 0.529 . . . . 73.010000000000005 110.277 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.24 -32.55 73.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.867 -0.606 . . . . 71.530000000000001 111.031 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.528 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 48.8 m -66.0 -37.95 87.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 121.046 0.45 . . . . 72.349999999999994 109.905 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.636 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.6 t80 -63.77 -40.01 95.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.731 -0.668 . . . . 73.349999999999994 109.774 177.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.743 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.9 ttm -66.47 -46.19 77.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.609 -0.723 . . . . 73.129999999999995 111.831 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.454 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 19.9 t-105 -63.08 -36.94 85.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 75.209999999999994 110.947 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.5 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -66.44 -37.89 86.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.094 -0.503 . . . . 74.519999999999996 111.493 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.581 HD11 ' HB3' ' B' ' 236' ' ' PHE . 44.4 tp -69.98 -28.45 65.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.013 0.435 . . . . 72.400000000000006 110.375 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.553 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -63.16 -42.26 99.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.948 -0.569 . . . . 73.340000000000003 111.0 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -77.41 -28.91 52.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.923 0.392 . . . . 75.439999999999998 110.574 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -76.7 -35.13 58.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.124 -0.489 . . . . 74.430000000000007 110.574 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -77.92 -32.17 51.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.308 -0.405 . . . . 73.109999999999999 112.048 -178.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.89 -20.65 66.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.266 0.555 . . . . 62.149999999999999 110.708 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -60.13 -33.56 72.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.265 -0.879 . . . . 74.549999999999997 111.078 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.451 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.9 m-85 -77.92 -3.49 42.07 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.154 -0.475 . . . . 75.319999999999993 112.156 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.51 ' O ' ' HE1' ' A' ' 58' ' ' MET . . . -63.51 -27.48 70.94 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.163 -1.018 . . . . 73.230000000000004 110.748 173.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.7 m -65.32 -18.1 65.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.13 -0.535 . . . . 72.349999999999994 111.833 -177.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -114.69 20.33 15.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.056 0.455 . . . . 71.400000000000006 110.88 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -83.48 -59.51 2.42 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.375 -0.375 . . . . 72.019999999999996 111.586 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.68 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 4.8 m-85 -134.86 175.32 9.67 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.106 0.41 . . . . 74.450000000000003 112.106 -175.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.529 ' HG3' HG22 ' A' ' 54' ' ' THR . 10.0 pt-20 -82.37 -40.29 21.53 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.707 -0.678 . . . . 75.450000000000003 111.854 -170.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.529 HG22 ' HG3' ' A' ' 53' ' ' GLU . 80.6 p -119.65 155.48 32.25 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.865 -0.42 . . . . 52.32 109.865 -178.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 12.1 ptmm? -67.44 -26.41 66.39 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.581 -0.448 . . . . 73.420000000000002 110.418 -176.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.0 -26.83 65.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.188 -0.46 . . . . 73.239999999999995 111.038 -177.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.72 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 17.8 mt-30 -97.21 -43.54 7.31 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.521 -0.548 . . . . 75.319999999999993 109.521 175.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.574 ' HE2' HG12 ' B' ' 285' ' ' ILE . 11.2 ttt -55.31 -44.21 75.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.169 -0.923 . . . . 64.409999999999997 111.721 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.41 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 47.5 tt0 -63.9 -42.42 97.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.077 -0.511 . . . . 72.209999999999994 110.827 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.71 -2.85 18.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.028 -0.533 . . . . 75.519999999999996 111.712 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.72 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 73.4 mmtt -104.1 1.05 30.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.422 -0.354 . . . . 72.329999999999998 110.826 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.54 ' O ' ' HG3' ' A' ' 66' ' ' MET . 0.0 OUTLIER -52.93 -46.01 67.92 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 123.209 0.318 . . . . 74.400000000000006 110.809 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.486 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 9.1 tp60 -77.91 -27.96 49.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.045 0.45 . . . . 74.219999999999999 110.014 -174.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -74.17 -29.38 61.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.892 -0.594 . . . . 72.319999999999993 111.176 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 ptp -86.1 -28.08 24.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.488 -0.56 . . . . 74.450000000000003 109.488 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.629 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 86.2 mtp -75.34 -18.14 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.548 -0.751 . . . . 73.310000000000002 111.313 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.0 -31.85 73.08 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.861 0.839 . . . . 65.400000000000006 109.465 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.437 ' HD2' ' CD ' ' A' ' 72' ' ' ARG . 85.9 m-85 -93.73 -4.34 50.6 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.639 -1.164 . . . . 74.519999999999996 111.155 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.629 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.8 m-30 -86.49 -53.87 4.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.014 -1.106 . . . . 74.420000000000002 108.014 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.565 ' HE3' HD12 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -58.96 -65.43 0.67 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.999 -0.546 . . . . 64.230000000000004 111.602 175.553 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.551 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 0.1 OUTLIER -98.77 24.2 7.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.861 1.43 . . . . 74.230000000000004 114.861 -159.807 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.437 ' CD ' ' HD2' ' A' ' 68' ' ' TYR . 1.2 mmp_? -112.96 -19.92 11.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.388 -0.925 . . . . 73.010000000000005 112.997 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.642 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -88.78 5.01 45.53 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.745 -0.835 . . . . 73.129999999999995 108.745 173.251 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.538 ' HA ' ' HE1' ' B' ' 270' ' ' MET . 78.3 tttt -61.57 -57.75 10.83 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.414 -1.266 . . . . 74.030000000000001 110.519 -177.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.34 -33.68 76.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.183 -0.462 . . . . 70.209999999999994 111.708 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.485 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 44.6 mtm -74.35 -23.29 59.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.276 0.56 . . . . 75.140000000000001 110.16 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.734 ' HB3' ' HE3' ' B' ' 266' ' ' MET . 3.4 tt -76.68 -35.29 58.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.566 -0.743 . . . . 71.340000000000003 109.209 176.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -59.6 -37.21 77.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.054 -0.976 . . . . 62.450000000000003 111.213 -178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.37 -19.5 63.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.8 -0.636 . . . . 64.450000000000003 112.095 -178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.24 -3.51 31.32 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 74.319999999999993 111.852 -176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.483 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 24.1 mmt -85.51 -176.26 6.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.696 0.284 . . . . 74.430000000000007 110.534 175.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.748 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 63.0 -10.46 0.1 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 114.027 1.121 . . . . 74.019999999999996 114.027 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 81' ' ' MET . 10.8 t70 -56.17 -65.37 0.61 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.039 0.447 . . . . 63.520000000000003 111.381 -176.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -72.91 -13.38 61.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.29 -0.414 . . . . 72.230000000000004 110.905 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.748 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.6 mt -76.89 -54.32 13.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.431 . . . . 75.109999999999999 110.83 -176.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.2 pt-20 -68.7 -22.37 64.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.982 0.42 . . . . 73.219999999999999 111.106 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -98.57 3.34 48.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.291 -0.413 . . . . 74.219999999999999 110.878 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.449 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 73.3 t80 -64.73 -37.42 87.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.733 -0.212 . . . . 75.409999999999997 110.491 -177.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -52.29 -42.28 63.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.584 0.707 . . . . 74.430000000000007 109.76 174.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -70.55 -44.96 66.37 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.935 -1.03 . . . . 71.420000000000002 110.849 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.563 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 57.4 m-85 -62.18 -40.08 94.84 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.234 0.54 . . . . 75.120000000000005 110.521 178.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.461 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 0.5 OUTLIER -61.35 -22.97 65.42 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.818 -0.628 . . . . 75.010000000000005 111.901 176.003 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -84.8 -27.6 26.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.113 -0.494 . . . . 63.409999999999997 111.354 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 17.9 p -97.11 1.92 50.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.21 0.528 . . . . 75.310000000000002 111.285 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.563 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 48.4 mt-30 -95.24 -175.44 3.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.875 -0.602 . . . . 74.239999999999995 110.925 177.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt . . . . . 0 C--N 1.322 -0.62 0 CA-C-N 115.66 -0.7 . . . . 74.140000000000001 110.545 -174.759 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 38.6 m . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 121.105 0.478 . . . . 73.25 110.555 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -82.65 97.14 8.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.585 . . . . 60.43 110.629 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.721 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 2.8 p-10 -166.25 130.44 2.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.023 0.439 . . . . 64.140000000000001 109.913 177.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -77.02 -76.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.995 -0.548 . . . . 64.25 110.891 -177.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -106.75 -45.31 4.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.472 0.653 . . . . 72.219999999999999 109.863 -178.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.721 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -102.18 169.33 8.79 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 73.140000000000001 111.173 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.528 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -83.77 54.25 2.82 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.833 0.853 . . . . 75.140000000000001 112.063 -177.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.525 ' CE1' ' HB1' ' B' ' 206' ' ' ALA . 29.1 m-85 -53.81 -43.54 69.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.474 . . . . 75.140000000000001 112.086 -175.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -71.34 -5.83 35.44 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.628 0.603 . . . . 63.399999999999999 112.628 -175.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -98.97 -59.97 1.62 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.906 -0.405 . . . . 73.420000000000002 109.906 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.871 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -59.35 -18.52 39.15 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.845 0.683 . . . . 72.310000000000002 112.845 -178.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.8 t -66.95 -19.62 65.75 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.131 -0.228 . . . . 61.439999999999998 111.094 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -86.67 -26.62 24.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.189 0.519 . . . . 73.450000000000003 109.894 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.871 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.45 -47.87 74.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.406 -0.815 . . . . 75.230000000000004 109.547 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.5 HG13 ' HB2' ' A' ' 39' ' ' ALA . 76.5 mt -66.3 -30.17 49.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.801 -0.636 . . . . 74.099999999999994 110.127 175.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' B' ' 216' ' ' LYS . 1.1 tmmt? -64.06 -31.85 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.575 -0.739 . . . . 71.120000000000005 111.204 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.656 HD13 HD11 ' A' ' 14' ' ' LEU . 2.8 tm? -67.86 -42.0 81.99 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.664 -0.865 . . . . 72.540000000000006 108.664 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.19 -35.8 76.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.677 -0.692 . . . . 60.130000000000003 110.719 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.427 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -63.2 -25.54 68.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.052 -0.522 . . . . 72.209999999999994 111.347 179.24 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.52 -36.26 29.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.45 -0.341 . . . . 74.329999999999998 111.304 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -74.77 -22.82 58.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.276 0.56 . . . . 73.450000000000003 110.354 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -72.65 -17.05 61.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.176 -0.92 . . . . 74.019999999999996 110.084 177.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 78.5 mm-40 -77.32 74.83 3.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.071 -0.513 . . . . 74.439999999999998 110.623 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.952 HD21 HG13 ' B' ' 227' ' ' ILE . 26.4 t30 -151.15 176.8 10.83 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.567 -0.901 . . . . 74.109999999999999 108.567 174.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.8 t -111.82 -37.94 4.99 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.397 -0.521 . . . . 74.329999999999998 112.082 -176.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -83.32 -28.02 29.35 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.171 0.434 . . . . 74.019999999999996 112.171 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.952 HG13 HD21 ' B' ' 224' ' ' ASN . 5.7 mt -76.87 151.01 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 74.319999999999993 110.257 -178.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.589 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 13.8 pm0 -101.96 157.05 17.14 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.872 -0.604 . . . . 75.450000000000003 109.487 173.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 17.8 m -58.18 -23.93 57.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.173 0.511 . . . . 63.140000000000001 110.86 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.451 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.84 -35.39 91.85 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.588 -0.733 . . . . 53.119999999999997 113.199 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.589 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 14.9 mm-40 -70.16 -24.84 63.22 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 117.276 0.538 . . . . 64.219999999999999 110.342 -175.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.24 -41.47 22.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.737 -0.665 . . . . 74.319999999999993 110.289 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.0 t -62.11 -43.71 98.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 64.239999999999995 110.297 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.7 -33.02 74.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.961 -0.563 . . . . 64.420000000000002 110.983 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.405 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 50.4 m -65.54 -38.41 89.56 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.013 0.435 . . . . 62.329999999999998 110.084 179.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.584 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.4 t80 -65.24 -36.53 84.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.587 0.708 . . . . 75.439999999999998 109.501 176.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.642 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.0 ttm -66.41 -49.39 66.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.287 -0.87 . . . . 74.340000000000003 111.949 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.53 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 21.6 t-105 -62.92 -37.82 88.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 71.540000000000006 110.732 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.571 ' HB3' ' HB2' ' A' ' 11' ' ' ALA . . . -64.89 -36.87 85.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.176 -0.465 . . . . 71.430000000000007 111.304 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 54.5 tp -67.76 -33.65 75.26 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.046 0.45 . . . . 72.329999999999998 110.166 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.542 ' HB1' ' HA ' ' A' ' 77' ' ' LEU . . . -60.99 -48.17 83.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 72.129999999999995 110.988 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -67.87 -34.78 77.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.331 -0.395 . . . . 74.530000000000001 111.08 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -74.14 -38.01 63.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.074 -0.512 . . . . 74.439999999999998 110.726 -176.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -75.2 -28.39 59.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.659 0.244 . . . . 72.230000000000004 111.659 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . 0.483 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.37 -15.6 62.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.286 0.565 . . . . 53.100000000000001 110.809 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -67.05 -33.99 76.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.451 -0.795 . . . . 75.0 110.561 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.441 ' CZ ' ' HA2' ' A' ' 30' ' ' GLY . 76.8 m-85 -78.68 -0.74 31.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.57 . . . . 75.239999999999995 112.044 -176.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.542 ' O ' ' HE3' ' B' ' 258' ' ' MET . . . -56.93 -36.33 72.85 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.42 -0.895 . . . . 72.140000000000001 111.235 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 5.1 m -68.37 -11.83 60.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.469 -0.365 . . . . 54.140000000000001 111.611 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 27.1 p -105.85 1.77 27.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.964 0.411 . . . . 74.239999999999995 110.59 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 32.0 t -77.98 -43.2 30.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.952 -0.567 . . . . 64.519999999999996 111.198 -175.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.489 ' HD1' ' HG2' ' B' ' 253' ' ' GLU . 0.3 OUTLIER -144.0 -179.71 6.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.36 0.6 . . . . 71.420000000000002 112.561 -174.08 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.489 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 7.1 pt-20 -94.49 -47.53 6.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.74 -1.118 . . . . 75.150000000000006 111.872 -172.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 74.3 p -111.91 156.49 21.98 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 109.538 -0.541 . . . . 72.340000000000003 109.538 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.449 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.3 ptmt -68.02 -31.89 71.88 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.422 -0.511 . . . . 64.340000000000003 110.701 -177.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -65.98 -37.1 85.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.941 0.4 . . . . 64.319999999999993 111.044 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.5 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 26.1 mt-30 -90.55 -14.8 31.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.281 -0.418 . . . . 74.140000000000001 110.828 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.542 ' HE3' ' O ' ' B' ' 248' ' ' GLY . 17.9 ttt -89.06 -40.17 13.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.942 -0.572 . . . . 74.310000000000002 110.541 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.461 ' O ' ' HD2' ' B' ' 262' ' ' LYS . 32.8 tt0 -63.02 -34.52 77.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 75.140000000000001 110.802 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.68 -3.63 19.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.352 -0.386 . . . . 71.340000000000003 110.709 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 73.3 mmtt -115.62 -9.65 11.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.323 -0.398 . . . . 61.399999999999999 112.055 -176.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.67 ' HA ' ' HE2' ' B' ' 265' ' ' MET . 0.0 OUTLIER -64.5 -27.07 68.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 120.021 -0.671 . . . . 73.549999999999997 110.73 -173.133 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -83.36 -41.12 18.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 110.108 -0.33 . . . . 75.319999999999993 110.108 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -62.59 -42.42 99.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 75.5 111.836 -177.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.67 ' HE2' ' HA ' ' B' ' 262' ' ' LYS . 24.3 ptp -68.25 -29.84 68.75 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.085 -0.709 . . . . 73.239999999999995 109.085 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.734 ' HE3' ' HB3' ' A' ' 77' ' ' LEU . 52.5 mtp -75.86 -36.31 59.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.161 -0.927 . . . . 73.010000000000005 110.92 178.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.53 -31.76 72.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 75.519999999999996 111.001 -165.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.68 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 17.6 p90 -97.02 -11.98 23.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.222 -0.445 . . . . 75.5 110.984 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -60.48 -47.66 85.18 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 110.135 -0.32 . . . . 71.540000000000006 110.135 177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.551 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -49.68 -45.73 49.08 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.672 -0.694 . . . . 70.340000000000003 110.231 174.135 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -92.1 26.06 2.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.86 -1.064 . . . . 65.519999999999996 111.698 -169.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.68 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 3.6 mmp_? -97.87 -46.79 5.81 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.729 -0.607 . . . . 72.109999999999999 111.455 -177.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.743 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -89.64 10.78 21.88 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.329 -0.548 . . . . 74.430000000000007 110.547 -178.575 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.437 ' HE3' ' HG2' ' A' ' 70' ' ' MET . 29.4 ttmt -60.32 -53.94 51.59 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.702 -0.681 . . . . 74.450000000000003 110.454 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.52 -40.88 96.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 71.319999999999993 111.492 -176.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 60.5 mtm -73.74 -29.78 62.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 60.149999999999999 110.663 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.565 HD12 ' HE3' ' A' ' 70' ' ' MET . 4.8 tt -72.6 -43.68 63.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 75.109999999999999 109.507 177.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.522 ' HB2' ' HE2' ' A' ' 66' ' ' MET . 22.4 t70 -62.54 -27.86 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.815 -0.63 . . . . 74.109999999999999 110.821 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.4 57.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 74.040000000000006 111.548 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -95.39 -8.36 35.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.227 0.536 . . . . 75.450000000000003 110.274 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 20.6 mmt -73.74 178.06 5.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.619 -0.719 . . . . 75.310000000000002 111.226 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.709 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 40.4 mt-10 70.09 -5.22 1.34 Allowed 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 113.998 1.111 . . . . 74.349999999999994 113.998 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.28 -68.5 0.34 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.116 0.417 . . . . 73.510000000000005 110.586 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -60.4 -28.72 68.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.848 0.356 . . . . 71.349999999999994 110.832 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.709 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 61.9 mt -64.53 -55.04 23.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.564 . . . . 72.540000000000006 111.628 -176.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.7 pt-20 -63.12 -25.95 68.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.907 0.384 . . . . 75.030000000000001 111.29 -177.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -97.27 5.62 49.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.191 -0.459 . . . . 65.430000000000007 111.196 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -54.99 -52.85 61.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.648 0.24 . . . . 71.120000000000005 111.648 -176.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -62.76 -25.85 68.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.638 0.256 . . . . 71.120000000000005 111.249 -177.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -66.83 -56.22 11.36 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.411 -0.588 . . . . 63.109999999999999 109.411 175.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . 0.67 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 34.7 m-85 -65.83 -35.1 79.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.143 -0.48 . . . . 74.319999999999993 111.287 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.814 ' HA ' HE21 ' B' ' 295' ' ' GLN . 8.1 tmm_? -66.29 -22.96 66.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.08 -0.509 . . . . 75.140000000000001 110.119 178.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -87.14 -32.41 19.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.055 -0.52 . . . . 75.340000000000003 110.782 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 23.4 p -84.18 -6.3 59.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.143 -0.48 . . . . 75.319999999999993 111.407 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.814 HE21 ' HA ' ' B' ' 292' ' ' ARG . 42.5 mt-30 -74.61 161.19 29.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.471 0.653 . . . . 61.420000000000002 111.012 175.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . 0.681 ' HE2' ' HA ' ' B' ' 296' ' ' LYS . 9.8 mmpt? . . . . . 0 C--O 1.25 1.093 0 CA-C-N 114.84 -1.073 . . . . 73.340000000000003 109.307 -177.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.846 0.355 . . . . 74.120000000000005 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -76.02 -39.74 55.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.262 0.553 . . . . 74.319999999999993 110.155 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -127.94 126.6 41.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.704 -0.68 . . . . 72.140000000000001 110.075 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.94 99.88 9.34 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 62.229999999999997 110.607 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 72.59 -60.77 0.52 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.333 -0.848 . . . . 75.219999999999999 111.537 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.1 154.55 29.28 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.892 -0.595 . . . . 53.420000000000002 111.65 -176.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.515 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -79.13 51.24 1.14 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.961 -1.018 . . . . 73.120000000000005 112.608 -175.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -54.03 -41.22 67.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.854 0.359 . . . . 75.430000000000007 111.154 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -4.77 34.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 62.009999999999998 112.361 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.442 ' NH2' ' HB3' ' B' ' 221' ' ' GLN . 60.7 mtp85 -99.86 -61.1 1.41 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.214 -0.291 . . . . 72.140000000000001 110.214 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.834 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.43 -22.49 12.73 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.77 0.656 . . . . 73.299999999999997 112.77 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.4 t -63.18 -22.71 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.706 0.289 . . . . 71.109999999999999 111.153 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.476 ' HB2' HD11 ' B' ' 217' ' ' LEU . 74.6 mt-10 -90.39 -28.08 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.075 0.464 . . . . 74.439999999999998 110.004 -178.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.834 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.8 mm? -62.39 -42.62 99.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 65.409999999999997 110.097 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.01 -23.21 21.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.506 -0.77 . . . . 73.030000000000001 111.093 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -64.22 -28.98 70.11 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 111.065 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' B' ' 213' ' ' GLU . 2.1 tm? -74.52 -43.23 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.438 -0.579 . . . . 73.409999999999997 109.438 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.28 75.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.965 -0.562 . . . . 62.439999999999998 111.416 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -66.45 -18.38 65.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.431 -0.349 . . . . 65.019999999999996 111.768 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -23.63 51.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.431 0.634 . . . . 75.319999999999993 109.864 177.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -99.23 -11.91 20.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.733 -0.667 . . . . 73.040000000000006 110.07 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.845 ' HA ' HG22 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -86.57 -21.44 26.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.495 -0.775 . . . . 63.340000000000003 110.064 -177.792 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -80.67 18.94 0.87 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.185 -0.462 . . . . 75.310000000000002 111.998 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.557 HD21 HG13 ' A' ' 27' ' ' ILE . 1.7 t30 -82.74 107.2 15.19 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.121 -1.066 . . . . 75.530000000000001 108.121 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -59.64 -32.38 70.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.807 0.669 . . . . 63.009999999999998 112.807 -171.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -91.44 11.77 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.768 0.655 . . . . 73.340000000000003 112.768 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.557 HG13 HD21 ' A' ' 24' ' ' ASN . 4.2 mt -120.52 152.07 23.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.022 0.439 . . . . 74.450000000000003 110.7 176.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.643 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 47.0 mt-30 -73.65 152.9 40.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 73.340000000000003 110.143 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.608 HG21 HD22 ' A' ' 22' ' ' ASN . 13.5 m -65.25 -34.15 77.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.206 0.527 . . . . 74.430000000000007 110.841 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.1 -2.43 78.19 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.954 -0.566 . . . . 74.150000000000006 113.708 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.643 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 52.5 mm-40 -86.47 -12.03 50.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.502 0.651 . . . . 74.310000000000002 110.246 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.845 HG22 ' HA ' ' A' ' 22' ' ' ASN . 21.3 t -91.74 -36.88 8.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.793 -0.64 . . . . 73.239999999999995 111.181 -176.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.9 p -58.65 -31.39 68.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 62.030000000000001 110.955 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.11 79.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.796 -0.638 . . . . 62.43 111.274 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.8 m -66.65 -36.38 82.42 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.123 0.487 . . . . 71.129999999999995 110.051 -178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.568 ' CD1' HD11 ' B' ' 214' ' ' LEU . 8.6 t80 -67.86 -35.54 78.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.761 -0.654 . . . . 74.200000000000003 109.509 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.571 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 11.5 ttt -66.48 -55.83 13.75 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.368 -0.833 . . . . 73.450000000000003 111.644 -178.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.613 ' CZ3' ' HB3' ' B' ' 276' ' ' MET . 16.7 t-105 -55.2 -41.1 71.53 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.283 -0.417 . . . . 74.140000000000001 111.142 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.465 ' HB3' ' HB2' ' B' ' 211' ' ' ALA . . . -60.72 -36.64 79.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.244 -0.434 . . . . 61.130000000000003 111.059 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.709 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.9 tp -69.69 -35.97 75.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 72.349999999999994 110.271 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.46 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.68 -49.92 75.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.774 -0.648 . . . . 72.519999999999996 111.306 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -80.21 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.51 -0.476 . . . . 71.230000000000004 111.297 -176.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -86.25 -39.49 16.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.402 -0.592 . . . . 75.299999999999997 109.402 175.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -72.81 -30.5 64.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 75.219999999999999 111.116 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.539 ' HA ' ' HE1' ' B' ' 281' ' ' MET . . . -72.37 -17.06 61.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 72.219999999999999 111.104 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -56.14 -38.19 70.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.846 -0.616 . . . . 73.549999999999997 110.373 177.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.543 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 69.7 m-85 -76.17 -11.31 59.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.734 -0.666 . . . . 72.219999999999999 112.072 -177.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.59 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -61.43 -33.55 85.07 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.394 -0.908 . . . . 72.409999999999997 111.484 177.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 60.2 p -60.76 -37.86 83.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.98 0.419 . . . . 71.209999999999994 111.493 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.6 t -95.07 13.98 23.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.149 0.5 . . . . 75.409999999999997 110.842 -175.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.1 t -76.36 -39.26 54.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 75.010000000000005 111.728 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.648 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -140.07 -167.67 2.36 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.481 -0.487 . . . . 74.549999999999997 112.258 -176.418 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.626 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.0 pt-20 -104.59 -40.33 6.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.373 -0.831 . . . . 61.149999999999999 111.686 -174.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.5 p -118.02 162.64 17.83 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.877 -0.416 . . . . 74.219999999999999 109.877 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.597 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 18.4 ptmt -71.66 -35.33 70.32 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.642 -0.423 . . . . 72.040000000000006 110.797 -177.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -64.93 -42.84 94.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.31 -0.405 . . . . 72.219999999999999 111.118 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.527 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.3 mt-30 -77.18 -36.1 55.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.886 0.374 . . . . 73.340000000000003 110.36 178.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.59 ' HE2' ' O ' ' A' ' 48' ' ' GLY . 15.9 ttt -63.25 -40.28 96.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.046 -0.525 . . . . 71.129999999999995 110.687 177.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.517 ' HA ' HD11 ' B' ' 285' ' ' ILE . 36.2 tt0 -62.11 -33.74 75.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.713 -0.676 . . . . 74.040000000000006 111.053 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.51 -1.61 38.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.353 -0.385 . . . . 75.219999999999999 111.421 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.648 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.9 mmmt -108.77 -0.38 19.98 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.408 -0.36 . . . . 73.420000000000002 111.413 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.625 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.0 ptpt -57.51 -50.81 71.86 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 123.3 0.375 . . . . 75.140000000000001 110.535 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.625 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -75.43 -14.17 60.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.428 -0.351 . . . . 75.519999999999996 110.623 -176.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -82.73 -44.86 15.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 73.5 111.431 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.424 ' CE ' ' HA ' ' A' ' 62' ' ' LYS . 3.9 ptt? -79.75 -22.49 43.17 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 119.914 -0.714 . . . . 73.140000000000001 109.617 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.592 ' HE3' ' HB2' ' B' ' 278' ' ' ASP . 56.9 mtp -89.44 -7.9 54.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.589 -0.732 . . . . 74.25 110.587 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -57.68 -45.47 85.56 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.166 0.508 . . . . 72.239999999999995 110.808 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.656 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 7.1 p90 -110.52 6.06 21.71 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.377 -0.829 . . . . 74.340000000000003 110.333 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.452 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -63.16 -53.67 49.7 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.217 -0.66 . . . . 71.549999999999997 109.217 173.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.542 ' HE1' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -55.88 -45.2 78.63 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.092 -0.706 . . . . 74.329999999999998 109.092 174.228 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.401 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 7.5 t70 -96.84 57.08 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.852 -1.067 . . . . 74.420000000000002 110.93 -173.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.656 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 7.8 mmm180 -122.29 -46.57 2.17 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 120.999 0.428 . . . . 74.439999999999998 110.648 172.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.749 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -92.25 12.56 21.98 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.49 0.662 . . . . 72.040000000000006 109.455 -178.529 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.561 ' HG3' ' SD ' ' B' ' 270' ' ' MET . 65.0 tttt -60.63 -63.82 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.463 -1.244 . . . . 75.219999999999999 110.658 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.27 -37.4 83.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.057 -0.52 . . . . 75.519999999999996 111.289 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.471 ' HB3' ' CZ3' ' B' ' 238' ' ' TRP . 47.3 mtm -69.05 -31.5 70.32 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 74.209999999999994 110.407 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.52 HD21 ' HG2' ' B' ' 266' ' ' MET . 5.6 tt -73.56 -42.14 62.04 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.549 -0.537 . . . . 65.329999999999998 109.549 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.812 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 23.1 t70 -61.53 -35.27 77.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.818 -0.628 . . . . 73.239999999999995 110.329 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.32 -13.72 62.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.444 -0.798 . . . . 64.129999999999995 111.523 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -100.61 -21.38 15.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.071 0.462 . . . . 74.040000000000006 109.759 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.52 ' O ' HG13 ' A' ' 85' ' ' ILE . 20.8 mmt -68.21 -55.73 11.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.832 -0.622 . . . . 71.219999999999999 110.18 174.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.623 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 12.5 pt-20 -57.29 -26.06 60.25 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 115.556 -0.747 . . . . 75.099999999999994 111.278 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -53.04 -48.49 67.6 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.042 0.448 . . . . 74.219999999999999 110.409 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -84.15 -25.01 29.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.152 -0.476 . . . . 73.400000000000006 110.721 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 81' ' ' MET . 67.5 mt -69.47 -56.87 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 75.109999999999999 110.919 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.1 pt-20 -68.96 -19.74 64.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 73.319999999999993 111.163 -176.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -103.95 18.88 21.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.516 -0.311 . . . . 74.129999999999995 111.174 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.462 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 21.4 t80 -56.84 -54.67 43.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.98 -0.378 . . . . 73.230000000000004 109.98 177.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -72.89 1.87 7.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.372 -0.376 . . . . 74.299999999999997 111.399 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -90.09 -52.59 4.87 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.833 -0.803 . . . . 74.319999999999993 108.833 173.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -70.73 -28.23 64.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.411 0.624 . . . . 74.430000000000007 110.391 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.532 ' HA ' ' HG2' ' A' ' 95' ' ' GLN . 1.2 tmm_? -77.75 -13.8 59.79 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.776 -0.647 . . . . 73.230000000000004 109.676 178.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -89.44 -25.54 21.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.688 -0.687 . . . . 75.420000000000002 110.569 177.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.9 p -87.85 -4.37 58.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.193 0.521 . . . . 71.230000000000004 110.818 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.532 ' HG2' ' HA ' ' A' ' 92' ' ' ARG . 11.5 pt20 -109.45 176.37 5.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 73.150000000000006 110.498 177.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm . . . . . 0 C--N 1.322 -0.605 0 CA-C-N 115.745 -0.661 . . . . 74.150000000000006 110.384 -178.111 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.233 0.54 . . . . 71.530000000000001 110.247 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -100.0 4.97 45.13 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.58 -0.736 . . . . 63.420000000000002 109.795 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -150.15 134.17 16.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.347 -0.842 . . . . 63.009999999999998 109.997 -176.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . 0.414 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 36.2 tt0 -78.93 81.55 5.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.129 -0.487 . . . . 71.409999999999997 110.854 -178.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 2.6 t30 72.64 -60.94 0.52 Allowed 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 124.107 0.963 . . . . 72.519999999999996 110.658 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -73.12 160.54 31.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.809 -0.632 . . . . 73.329999999999998 111.648 -176.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.483 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -82.25 49.47 1.42 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.338 -0.846 . . . . 73.140000000000001 111.805 -177.362 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.414 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 67.0 m-85 -53.21 -45.63 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.094 0.473 . . . . 70.030000000000001 110.735 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.97 -18.17 64.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.463 -0.79 . . . . 73.010000000000005 112.212 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.609 HH22 HG21 ' A' ' 32' ' ' VAL . 25.4 mtp180 -90.41 -62.27 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.156 -0.313 . . . . 63.149999999999999 110.156 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.767 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -54.16 -26.75 29.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.091 0.775 . . . . 63.409999999999997 113.091 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.5 t -65.58 -18.32 65.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.509 0.195 . . . . 75.310000000000002 111.188 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 21.2 mt-10 -96.49 -16.73 20.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.062 0.458 . . . . 74.409999999999997 110.391 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.767 HD22 ' HA ' ' B' ' 211' ' ' ALA . 3.9 mm? -69.11 -45.01 71.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.888 -0.782 . . . . 73.5 108.888 173.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.452 HG13 ' HB1' ' A' ' 39' ' ' ALA . 66.7 mt -69.2 -24.85 28.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.394 -0.821 . . . . 74.319999999999993 110.339 175.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.515 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.7 tmtp? -59.69 -35.71 75.03 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.678 -0.692 . . . . 72.329999999999998 110.709 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.722 HD13 HD11 ' A' ' 14' ' ' LEU . 3.0 tm? -71.41 -42.35 68.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.185 -0.672 . . . . 74.530000000000001 109.185 176.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.59 -39.07 86.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 75.230000000000004 111.04 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -61.22 -33.77 74.03 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.849 0.357 . . . . 74.310000000000002 111.074 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -34.78 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 74.209999999999994 110.459 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . 0.442 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 56.3 mt-30 -82.77 -17.34 44.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.364 0.602 . . . . 73.329999999999998 110.255 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . 0.674 HD22 HG22 ' B' ' 229' ' ' THR . 25.5 t-20 -76.25 -5.47 47.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.154 -0.93 . . . . 75.329999999999998 109.779 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -77.41 2.37 16.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 73.209999999999994 111.356 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.7 131.99 52.54 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.099 0.476 . . . . 74.450000000000003 110.262 175.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.8 t -94.69 -22.96 17.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.834 -0.621 . . . . 73.430000000000007 110.063 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . 0.43 ' HG2' HG13 ' B' ' 227' ' ' ILE . 1.5 pm0 -88.73 -21.82 23.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.65 -0.704 . . . . 72.439999999999998 111.455 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.43 HG13 ' HG2' ' B' ' 226' ' ' GLU . 6.3 mt -110.01 150.95 12.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.873 0.368 . . . . 75.420000000000002 110.619 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -93.44 175.56 6.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.836 -0.62 . . . . 74.0 110.193 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 229' ' ' THR . . . . . 0.674 HG22 HD22 ' B' ' 222' ' ' ASN . 3.4 m -64.29 -31.56 72.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.156 -0.474 . . . . 75.129999999999995 111.588 -175.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.543 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -61.5 -25.62 65.41 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 114.865 0.706 . . . . 71.5 114.865 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -88.06 -15.99 34.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.697 0.748 . . . . 63.420000000000002 111.635 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . 0.511 HG21 ' HA ' ' B' ' 222' ' ' ASN . 35.9 t -81.11 -37.4 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.963 -0.295 . . . . 74.129999999999995 110.896 -176.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 8.7 p -60.25 -34.64 73.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.286 0.565 . . . . 65.129999999999995 110.567 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.11 -32.02 72.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.751 . . . . 71.450000000000003 111.635 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 18.3 m -67.64 -32.81 73.76 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.137 0.494 . . . . 71.409999999999997 109.738 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.636 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 4.7 t80 -71.91 -34.81 69.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 74.329999999999998 109.239 177.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.749 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.9 tpt -60.41 -55.81 29.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 74.010000000000005 110.916 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.515 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 28.3 t-105 -63.87 -33.8 76.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.73 -0.668 . . . . 75.549999999999997 111.739 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.462 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -64.99 -39.61 93.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.597 -0.274 . . . . 71.230000000000004 111.16 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.456 HD21 ' HG3' ' A' ' 37' ' ' MET . 61.6 tp -68.19 -29.94 68.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.931 0.396 . . . . 74.340000000000003 110.416 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.09 -47.47 82.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.933 -0.576 . . . . 64.140000000000001 111.303 -178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -84.01 -5.97 59.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.846 -0.342 . . . . 73.010000000000005 110.902 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -89.37 -41.03 12.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.231 -0.655 . . . . 74.109999999999999 109.231 175.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -75.18 -36.73 61.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.791 -0.64 . . . . 72.239999999999995 111.761 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -68.01 -17.14 64.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.061 0.457 . . . . 71.340000000000003 111.021 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -68.05 -17.82 64.51 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 74.519999999999996 110.009 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -96.71 -0.06 48.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.124 -0.489 . . . . 75.040000000000006 111.206 177.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.44 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -75.8 -29.77 58.78 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.6 -0.81 . . . . 64.209999999999994 111.671 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 18.6 p -72.11 -18.12 61.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.865 0.365 . . . . 72.409999999999997 111.235 -177.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 15.3 t -103.95 16.79 25.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.538 0.685 . . . . 74.319999999999993 110.117 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 10.6 t -82.06 -44.21 16.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.585 -0.734 . . . . 72.200000000000003 110.329 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.722 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 0.4 OUTLIER -138.94 -172.37 3.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.471 -0.331 . . . . 74.340000000000003 111.159 -179.602 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -102.96 -44.57 5.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.109999999999999 111.592 -173.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 56.4 p -107.33 151.63 25.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.72 -0.218 . . . . 73.209999999999994 110.551 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.462 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 22.5 ptmt -63.27 -32.51 73.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.4 . . . . 73.109999999999999 110.636 -178.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -60.14 -54.17 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.859 -0.609 . . . . 75.219999999999999 110.299 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.647 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 22.3 mt-30 -71.4 -42.88 67.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.838 -0.619 . . . . 73.019999999999996 110.363 -178.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.44 ' HE2' ' O ' ' B' ' 248' ' ' GLY . 14.5 ttt -57.27 -42.06 80.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 72.439999999999998 111.233 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -63.23 -33.02 74.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.061 -0.518 . . . . 72.519999999999996 111.245 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -78.3 -4.51 48.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.992 0.425 . . . . 62.030000000000001 111.061 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.722 ' HE2' ' HE2' ' B' ' 252' ' ' PHE . 27.1 mmmt -112.91 3.83 16.51 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.156 -176.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.649 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 17.3 ptpt -55.86 -52.97 62.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.073 -0.512 . . . . 71.230000000000004 110.647 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.649 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.0 tp60 -66.57 -30.55 70.88 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.529 -0.305 . . . . 71.540000000000006 110.789 -176.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.437 -0.347 . . . . 75.120000000000005 111.53 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.504 ' CE ' ' HA ' ' B' ' 262' ' ' LYS . 4.8 ptt? -79.47 -28.13 41.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 120.274 -0.57 . . . . 72.230000000000004 110.191 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.812 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 72.8 mtp -77.32 -24.24 50.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.718 -0.674 . . . . 74.299999999999997 111.613 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -66.19 -25.95 67.17 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.53 0.681 . . . . 62.109999999999999 109.214 -174.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.427 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 28.1 m-85 -94.29 -17.24 22.83 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.893 -1.048 . . . . 74.200000000000003 111.35 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.476 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.5 m-30 -72.55 -40.45 66.7 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.247 -1.02 . . . . 75.109999999999999 108.247 171.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.561 ' SD ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.75 -63.61 1.09 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.033 -0.531 . . . . 74.209999999999994 110.386 169.701 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . 0.409 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 24.5 t0 -98.84 76.87 2.19 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.742 0.645 . . . . 74.109999999999999 112.742 -169.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 4.5 mmm180 -152.87 -34.49 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.955 -0.566 . . . . 74.019999999999996 111.081 166.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.571 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.84 0.66 46.62 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 108.988 -0.745 . . . . 74.230000000000004 108.988 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.542 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 80.1 tttt -61.29 -52.58 64.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.806 -1.088 . . . . 75.319999999999993 110.827 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -58.91 -38.74 79.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.192 0.52 . . . . 73.519999999999996 111.129 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 276' ' ' MET . . . . . 0.613 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 55.2 mtm -80.34 -24.69 39.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.836 -0.62 . . . . 64.129999999999995 110.427 -177.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.483 HD21 ' HG2' ' A' ' 66' ' ' MET . 4.9 tt -72.42 -43.45 63.84 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.814 -0.81 . . . . 74.420000000000002 108.814 174.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.592 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 11.2 t70 -56.93 -39.85 75.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.085 -0.962 . . . . 64.439999999999998 110.291 177.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -61.91 -24.03 66.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.091 -0.958 . . . . 73.329999999999998 112.008 -177.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -98.4 -13.98 20.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.913 0.387 . . . . 64.030000000000001 110.516 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.539 ' HE1' ' HA ' ' A' ' 45' ' ' ALA . 16.1 mmt -69.66 -55.21 10.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.934 -0.575 . . . . 74.409999999999997 110.786 178.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 7.3 pt-20 -78.61 0.76 25.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.942 -0.572 . . . . 64.549999999999997 112.495 -174.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.73 -45.92 92.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.278 0.561 . . . . 71.209999999999994 109.601 173.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -82.37 -19.72 38.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.543 -0.753 . . . . 72.420000000000002 110.471 177.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.538 ' CG1' ' HA ' ' B' ' 282' ' ' GLU . 68.6 mt -71.87 -55.29 13.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 120.905 0.384 . . . . 74.310000000000002 110.572 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -65.78 -18.53 65.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 74.430000000000007 110.937 -178.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . 0.404 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 57.8 m-80 -112.32 18.9 18.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.446 -0.343 . . . . 75.430000000000007 111.462 179.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.597 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 26.4 t80 -53.59 -54.6 35.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.699 0.285 . . . . 75.310000000000002 110.833 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -77.36 2.93 14.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.329 -0.396 . . . . 71.239999999999995 111.246 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -88.19 -50.38 6.4 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.647 -0.871 . . . . 75.530000000000001 108.647 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -71.71 -41.86 68.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.643 -0.708 . . . . 74.530000000000001 110.285 177.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.507 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 3.6 tmm_? -70.01 -13.33 62.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.799 -0.637 . . . . 74.450000000000003 110.492 -177.519 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -93.75 -30.12 15.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.131 -0.486 . . . . 72.310000000000002 111.01 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 7.3 p -79.86 -21.42 44.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.581 -0.281 . . . . 75.430000000000007 111.187 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' B' ' 292' ' ' ARG . 6.8 pt20 -80.8 161.61 24.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.374 -0.375 . . . . 74.409999999999997 110.126 173.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.247 -0.882 . . . . 73.25 109.899 -174.785 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 110.185 -0.302 . . . . 73.25 110.185 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -76.31 -13.44 60.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.08 0.467 . . . . 71.219999999999999 111.002 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -80.27 116.16 20.2 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.133 -0.485 . . . . 71.329999999999998 110.083 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.552 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . 3.3 tm-20 -65.28 -43.96 89.54 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.314 -0.995 . . . . 72.430000000000007 108.314 169.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.618 ' H ' ' HE2' ' A' ' 8' ' ' TYR . 9.1 t30 -148.04 -30.33 0.3 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.906 -1.043 . . . . 64.329999999999998 109.767 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.46 -162.75 1.62 Allowed 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 112.511 0.56 . . . . 72.340000000000003 112.511 -173.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.457 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.6 OUTLIER -71.58 42.33 0.08 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.097 1.359 . . . . 72.109999999999999 114.312 -172.396 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.618 ' HE2' ' H ' ' A' ' 5' ' ' ASN . 75.2 m-85 -57.9 -41.5 82.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 118.009 0.368 . . . . 73.340000000000003 111.469 -176.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.46 -18.96 65.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 64.400000000000006 111.913 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -92.93 -52.8 4.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.525 0.194 . . . . 75.340000000000003 111.525 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.753 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -54.6 -25.02 23.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.552 0.575 . . . . 73.409999999999997 112.552 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.9 t -68.13 -23.0 64.84 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.674 0.273 . . . . 74.420000000000002 111.028 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.572 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.3 mt-10 -79.19 -27.22 42.59 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.361 0.6 . . . . 75.310000000000002 109.392 -178.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.753 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -65.75 -48.98 70.04 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.033 -0.985 . . . . 75.109999999999999 109.597 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.516 HG21 ' HD2' ' B' ' 243' ' ' TYR . 81.4 mt -67.82 -29.44 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.587 -0.733 . . . . 63.520000000000003 110.198 176.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.432 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.3 tmmt? -60.18 -30.5 69.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.732 -0.667 . . . . 72.349999999999994 111.023 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.401 HD13 HD12 ' B' ' 214' ' ' LEU . 3.0 tm? -69.32 -45.23 70.01 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.29 -0.633 . . . . 74.430000000000007 109.29 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -32.27 72.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.636 -0.711 . . . . 70.040000000000006 110.921 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.6 m-20 -56.01 -35.72 67.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.071 -0.513 . . . . 74.430000000000007 110.624 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.54 -37.95 65.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 72.430000000000007 111.122 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -74.13 -22.36 59.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.918 0.389 . . . . 74.439999999999998 110.849 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -79.71 -12.71 59.79 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.185 0.517 . . . . 74.519999999999996 109.872 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 78.1 mm-40 -81.9 -4.85 57.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.97 -0.559 . . . . 74.219999999999999 110.328 175.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.578 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.6 t30 -80.03 135.01 36.26 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.256 0.55 . . . . 75.200000000000003 110.61 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -74.98 -36.39 62.03 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.228 -0.896 . . . . 72.439999999999998 111.84 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.58 -23.56 56.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 74.349999999999994 111.602 -174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.578 HG13 ' HB3' ' A' ' 24' ' ' ASN . 2.5 mt -97.12 163.43 2.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.867 0.365 . . . . 71.439999999999998 110.262 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -119.8 163.52 17.37 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.845 -0.616 . . . . 73.319999999999993 109.392 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -54.65 -32.21 58.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.933 0.397 . . . . 73.340000000000003 111.509 -176.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.54 -42.21 99.72 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.232 -0.508 . . . . 73.409999999999997 113.473 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.407 ' HB2' HG21 ' A' ' 27' ' ' ILE . 21.0 mm-40 -73.04 -37.82 66.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.127 0.463 . . . . 72.109999999999999 111.221 -173.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -69.12 -36.99 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.193 0.52 . . . . 73.349999999999994 110.657 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 m -74.94 -40.01 61.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.091 0.472 . . . . 73.230000000000004 110.705 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.95 -30.33 63.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 73.219999999999999 111.867 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.486 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 11.0 p -66.98 -30.75 70.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.6 0.238 . . . . 74.0 110.727 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.548 ' CD1' HD13 ' B' ' 214' ' ' LEU . 4.9 t80 -66.16 -33.58 76.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.16 0.505 . . . . 63.310000000000002 109.772 177.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.525 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.8 ttm -70.54 -47.49 60.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.861 -0.609 . . . . 74.129999999999995 111.104 178.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -63.3 -37.89 89.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.931 0.396 . . . . 72.340000000000003 110.616 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.405 ' HB3' HG13 ' B' ' 215' ' ' ILE . . . -65.95 -36.8 84.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.197 -0.456 . . . . 74.209999999999994 111.196 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.593 HD23 ' SD ' ' B' ' 237' ' ' MET . 52.3 tp -66.62 -32.4 73.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.001 0.429 . . . . 73.439999999999998 110.022 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.447 ' HA ' HD11 ' B' ' 277' ' ' LEU . . . -66.91 -46.25 75.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.795 -0.639 . . . . 63.240000000000002 110.704 177.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.3 mtp180 -69.05 -25.11 64.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.896 0.379 . . . . 75.439999999999998 110.949 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -84.29 -45.03 13.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 73.099999999999994 111.057 -177.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -68.51 -28.39 66.96 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.081 0.4 . . . . 71.409999999999997 112.081 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.14 60.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.998 0.428 . . . . 73.109999999999999 111.054 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -66.94 -17.67 65.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.639 0.733 . . . . 72.299999999999997 110.047 176.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.431 ' CZ ' HG22 ' B' ' 229' ' ' THR . 83.0 m-85 -93.3 0.32 56.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.761 -0.654 . . . . 71.299999999999997 111.156 177.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.451 ' C ' ' HE3' ' A' ' 58' ' ' MET . . . -73.46 -37.05 53.92 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.454 -0.879 . . . . 61.520000000000003 111.323 176.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -73.03 -0.21 13.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.954 0.407 . . . . 74.230000000000004 111.574 -177.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.7 t -123.53 17.55 9.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.338 0.59 . . . . 73.430000000000007 109.486 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.9 t -93.93 -31.43 14.29 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.813 -0.63 . . . . 63.509999999999998 110.867 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.694 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -143.29 -174.29 4.17 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 120.947 0.403 . . . . 75.120000000000005 111.368 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.621 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 7.7 pt-20 -98.54 -41.4 7.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.573 -0.74 . . . . 74.099999999999994 111.383 -173.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 82.7 p -120.93 161.84 20.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.094 -0.336 . . . . 74.430000000000007 110.094 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.441 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 22.2 ptmt -72.88 -34.57 66.78 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.918 -0.313 . . . . 74.230000000000004 110.538 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.14 -31.99 73.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.168 -0.469 . . . . 71.430000000000007 110.386 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.644 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 20.2 mt-30 -90.48 -37.72 13.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.007 -0.542 . . . . 73.150000000000006 110.464 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.451 ' HE3' ' C ' ' A' ' 48' ' ' GLY . 10.5 ttt -61.81 -42.41 98.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.288 -0.414 . . . . 74.400000000000006 110.988 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.85 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.001 -0.545 . . . . 70.129999999999995 110.991 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.07 -6.73 58.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 61.009999999999998 111.27 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.694 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 30.2 mmmt -108.56 4.37 23.99 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 116.486 -0.325 . . . . 73.409999999999997 110.79 -178.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.632 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 18.3 ptpt -53.72 -45.05 70.35 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.338 0.399 . . . . 75.420000000000002 111.017 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.431 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 8.5 tp60 -79.9 -14.18 58.82 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.882 -0.327 . . . . 64.209999999999994 110.654 -176.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -93.37 -6.67 46.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.393 -0.367 . . . . 72.230000000000004 110.929 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.632 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 20.5 ptp -106.39 -25.05 12.07 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.323 -0.621 . . . . 74.319999999999993 109.323 169.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.509 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 82.2 mtp -94.02 -0.47 55.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.449 -0.796 . . . . 65.349999999999994 112.498 -175.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.26 -33.08 59.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.7 0.762 . . . . 72.230000000000004 109.34 -175.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.641 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 10.8 m-85 -84.27 -16.14 44.21 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.754 -1.112 . . . . 75.230000000000004 110.913 175.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.637 ' O ' ' HE2' ' B' ' 237' ' ' MET . 13.8 m-30 -73.66 -42.21 61.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.263 -0.426 . . . . 73.109999999999999 109.981 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.732 ' HE2' HD22 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -74.72 -56.71 4.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.279 -0.569 . . . . 63.25 109.804 170.485 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -102.67 83.73 2.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.09 -0.504 . . . . 72.219999999999999 112.354 -171.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.641 ' HB2' ' O ' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -164.16 -36.93 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.092 -0.504 . . . . 75.109999999999999 111.059 169.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.564 ' HB3' ' HE3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -86.87 7.84 25.5 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.834 0.826 . . . . 74.230000000000004 108.838 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.412 ' HE2' HE22 ' B' ' 263' ' ' GLN . 47.6 tttm -62.64 -54.52 38.33 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.318 -1.31 . . . . 75.109999999999999 110.172 175.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -58.92 -35.57 73.3 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.147 -0.479 . . . . 73.340000000000003 110.625 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.406 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 50.6 mtt -67.28 -36.75 82.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.617 -0.719 . . . . 74.010000000000005 109.974 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.774 ' HB3' ' HE2' ' B' ' 266' ' ' MET . 0.9 OUTLIER -75.47 -40.9 56.8 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.264 -0.88 . . . . 74.140000000000001 110.224 -178.442 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -53.71 -38.94 64.78 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.315 0.579 . . . . 72.209999999999994 110.175 174.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -31.57 71.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.038 -0.983 . . . . 64.140000000000001 111.523 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.488 HD22 ' HG2' ' B' ' 242' ' ' ARG . 42.8 m-80 -85.09 -32.5 22.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.741 -0.466 . . . . 75.530000000000001 109.741 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.502 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.6 mmt -62.39 -62.17 1.94 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 65.430000000000007 110.475 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 24.6 mm-40 -54.1 -31.7 52.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 72.530000000000001 111.334 -178.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.45 -46.44 80.34 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.346 0.404 . . . . 60.009999999999998 111.328 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -82.53 -28.98 30.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 60.350000000000001 110.695 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.516 HG22 ' HB2' ' B' ' 259' ' ' GLN . 87.3 mt -67.91 -53.48 30.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 71.439999999999998 111.549 -178.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.4 pt-20 -65.32 -25.69 67.72 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.788 0.328 . . . . 73.319999999999993 111.093 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.8 m-80 -102.83 14.94 30.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.553 -0.294 . . . . 72.349999999999994 111.212 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.536 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 62.1 t80 -53.24 -53.83 45.08 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.025 0.203 . . . . 75.349999999999994 111.328 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -66.53 -30.55 70.89 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.834 0.349 . . . . 73.040000000000006 110.329 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -58.51 -52.18 66.73 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.032 -0.531 . . . . 75.019999999999996 110.232 175.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -70.05 -36.83 75.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.436 0.636 . . . . 74.129999999999995 110.172 177.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.481 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 4.2 tmm_? -63.87 -20.69 66.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.316 -0.856 . . . . 75.420000000000002 109.988 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -86.55 -26.73 24.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.107 -0.497 . . . . 71.209999999999994 110.954 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 20.4 p -81.35 -20.76 39.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.411 -0.359 . . . . 70.310000000000002 111.303 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -85.56 159.02 19.98 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.671 -0.492 . . . . 75.109999999999999 109.671 175.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.8 mttm . . . . . 0 C--N 1.319 -0.746 0 CA-C-N 116.222 -0.445 . . . . 74.030000000000001 110.574 -175.371 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.233 0.234 0 CA-C-O 120.844 0.354 . . . . 71.129999999999995 111.069 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . 0.616 ' HB2' ' HB2' ' B' ' 209' ' ' ALA . 33.0 m-80 -110.91 10.66 22.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.283 0.563 . . . . 75.200000000000003 109.542 175.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -138.2 108.04 6.3 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.718 -0.674 . . . . 75.140000000000001 110.661 -174.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.02 -70.09 0.21 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.484 -0.562 . . . . 65.340000000000003 109.484 170.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -142.56 9.6 1.81 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.903 0.859 . . . . 72.219999999999999 109.124 174.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.556 ' HB2' ' CE2' ' B' ' 208' ' ' TYR . . . -124.58 170.37 10.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 74.530000000000001 111.875 -171.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.486 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -86.59 38.04 0.77 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.423 -0.808 . . . . 75.129999999999995 112.061 -175.64 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.556 ' CE2' ' HB2' ' B' ' 206' ' ' ALA . 65.0 m-85 -52.63 -55.71 20.54 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.687 0.254 . . . . 72.329999999999998 111.687 -177.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . 0.616 ' HB2' ' HB2' ' B' ' 202' ' ' ASN . . . -61.69 -18.46 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.066 -0.515 . . . . 70.209999999999994 112.338 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -86.79 -54.49 4.33 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.146 -0.222 . . . . 73.25 110.662 178.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.612 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -55.1 -28.32 51.68 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.432 0.53 . . . . 74.25 112.432 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 12.5 t -70.34 -16.4 62.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 120.759 -0.376 . . . . 64.129999999999995 111.264 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 36.8 mt-10 -82.96 -29.23 29.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.837 -0.801 . . . . 75.519999999999996 108.837 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.612 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.0 -44.8 79.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.903 -1.044 . . . . 75.420000000000002 108.95 176.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.405 HG13 ' HB3' ' A' ' 39' ' ' ALA . 73.0 mt -69.62 -27.39 33.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.39 -0.823 . . . . 65.109999999999999 110.512 177.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.461 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.0 OUTLIER -57.52 -38.63 74.99 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.259 -0.428 . . . . 65.439999999999998 110.982 -179.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -70.16 -42.59 72.31 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.224 -0.658 . . . . 73.239999999999995 109.224 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . 0.467 ' O ' HG12 ' B' ' 232' ' ' VAL . . . -60.03 -42.43 94.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.058 -0.519 . . . . 64.239999999999995 110.731 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.559 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.4 m-20 -56.24 -34.22 66.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.235 -0.439 . . . . 70.329999999999998 110.587 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.33 -34.08 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.007 -0.542 . . . . 73.349999999999994 111.297 -178.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -75.39 -25.91 58.01 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.213 0.53 . . . . 72.219999999999999 110.495 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . 0.419 ' HA ' HG22 ' B' ' 232' ' ' VAL . 2.9 t-20 -68.27 -21.4 64.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.51 -0.768 . . . . 72.129999999999995 109.125 177.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 60.1 mm-40 -85.32 0.68 51.27 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.383 -0.826 . . . . 73.230000000000004 111.077 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.703 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 33.5 t30 -78.01 123.15 26.48 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 109.691 -0.485 . . . . 74.019999999999996 109.691 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.3 t -54.98 -26.01 33.77 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.91 -1.041 . . . . 74.439999999999998 113.434 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -105.08 9.05 34.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.381 0.512 . . . . 73.319999999999993 112.381 -173.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.703 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 6.2 mm -108.16 152.14 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.397 0.618 . . . . 75.239999999999995 111.306 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.539 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 32.8 mt-30 -92.11 152.13 20.07 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.143 -0.935 . . . . 75.519999999999996 108.596 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 229' ' ' THR . . . . . 0.431 HG22 ' CZ ' ' A' ' 47' ' ' PHE . 16.8 m -56.46 -38.22 71.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.922 0.392 . . . . 72.209999999999994 110.755 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.28 -0.18 76.78 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.216 -0.516 . . . . 72.239999999999995 113.964 -176.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.539 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 42.1 mt-10 -90.02 -27.42 19.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.862 0.831 . . . . 71.510000000000005 110.406 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . 0.467 HG12 ' O ' ' B' ' 218' ' ' ALA . 12.1 t -76.94 -23.94 15.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.741 -0.663 . . . . 75.200000000000003 110.682 -176.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.5 p -77.46 -32.61 54.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.368 0.604 . . . . 52.039999999999999 109.806 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.71 65.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.529 -0.759 . . . . 63.200000000000003 111.044 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.457 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 16.8 p -66.86 -37.11 83.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.706 0.288 . . . . 75.310000000000002 110.334 177.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.551 ' CD1' HD13 ' A' ' 14' ' ' LEU . 2.7 t80 -67.13 -37.71 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.424 0.631 . . . . 70.340000000000003 109.323 175.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.637 ' HE2' ' O ' ' A' ' 69' ' ' TYR . 10.7 tpt -58.07 -59.77 4.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.924 -1.034 . . . . 54.149999999999999 111.006 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.406 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 13.6 t-105 -59.43 -37.14 77.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 75.209999999999994 111.593 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.414 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -64.19 -39.08 93.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.374 -0.375 . . . . 71.129999999999995 111.34 -178.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.499 HD13 ' HB3' ' A' ' 36' ' ' PHE . 53.7 tp -68.77 -33.52 74.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.29 -0.263 . . . . 75.420000000000002 110.29 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.51 -35.42 75.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 71.239999999999995 111.104 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . 0.488 ' HG2' HD22 ' A' ' 80' ' ' ASN . 34.5 mtp180 -80.44 -45.87 16.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.181 -0.463 . . . . 75.450000000000003 110.742 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.516 ' HD2' HG21 ' A' ' 15' ' ' ILE . 12.2 t80 -68.52 -40.32 80.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.112 -0.495 . . . . 73.010000000000005 111.315 -174.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -64.73 -35.09 79.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.159 0.504 . . . . 75.209999999999994 110.931 -175.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -68.4 -2.04 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.871 -0.604 . . . . 71.319999999999993 112.242 -177.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -64.16 -26.92 68.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.218 0.532 . . . . 74.129999999999995 110.115 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -81.76 -5.27 58.0 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.134 -0.354 . . . . 75.319999999999993 111.13 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.433 ' O ' ' HE3' ' B' ' 258' ' ' MET . . . -71.03 -40.55 62.1 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.643 -0.789 . . . . 65.109999999999999 111.999 178.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 4.5 p -70.04 -14.25 62.59 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.869 0.322 . . . . 61.310000000000002 111.869 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.0 t -111.19 19.68 18.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.364 0.602 . . . . 72.219999999999999 110.022 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 8.2 t -84.94 -43.79 13.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.032 -0.531 . . . . 72.439999999999998 111.29 -176.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.559 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -143.2 -177.65 5.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.362 0.601 . . . . 75.140000000000001 112.353 -176.01 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.481 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 9.6 pt-20 -92.32 -37.03 12.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.973 -1.012 . . . . 74.329999999999998 111.832 -171.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.7 p -126.47 161.28 28.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.38 -0.23 . . . . 62.509999999999998 110.38 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.536 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 17.0 ptmt -64.14 -39.02 93.12 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 71.239999999999995 111.067 -177.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' B' ' 255' ' ' LYS . 37.1 mt-10 -59.89 -47.4 85.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.088 0.471 . . . . 75.239999999999995 111.026 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.658 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.8 mt-30 -80.48 -30.04 37.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.967 -0.56 . . . . 63.329999999999998 110.421 -176.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.433 ' HE3' ' O ' ' B' ' 248' ' ' GLY . 14.0 ttt -67.03 -45.04 78.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 73.430000000000007 110.398 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.516 ' HB2' HG22 ' A' ' 85' ' ' ILE . 33.2 tt0 -63.03 -32.55 73.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.701 -0.681 . . . . 74.5 111.064 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -72.9 -11.33 60.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.178 -0.464 . . . . 74.239999999999995 111.055 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.658 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -107.1 -4.13 19.22 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 110.059 -0.348 . . . . 74.120000000000005 110.059 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.533 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 36.4 ttpt -52.3 -56.29 15.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.761 -0.654 . . . . 65.219999999999999 110.686 -177.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.412 HE22 ' HE2' ' A' ' 74' ' ' LYS . 15.2 tp60 -64.74 -30.92 71.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 75.209999999999994 111.004 -178.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -70.12 -45.48 66.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.329 -0.396 . . . . 74.219999999999999 111.909 -176.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.533 ' CE ' ' HA ' ' B' ' 262' ' ' LYS . 3.0 ptt? -77.73 -24.43 49.12 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 119.734 -0.786 . . . . 55.340000000000003 109.542 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.774 ' HE2' ' HB3' ' A' ' 77' ' ' LEU . 84.5 mtp -79.61 -13.39 59.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.591 -0.731 . . . . 71.219999999999999 111.431 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.17 -30.07 69.1 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.484 -0.932 . . . . 72.030000000000001 108.484 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 21.8 m-85 -93.7 -10.22 35.12 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.332 -1.304 . . . . 75.209999999999994 111.486 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.466 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 20.2 m-30 -79.82 -40.73 27.91 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.281 -1.007 . . . . 75.439999999999998 108.281 172.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.462 ' N ' ' HE1' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.7 -59.01 3.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.087 -0.506 . . . . 65.450000000000003 110.199 170.026 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.16 83.65 2.0 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.168 0.433 . . . . 75.400000000000006 112.168 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 9.7 mmm180 -154.04 -30.02 0.12 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.972 -0.558 . . . . 72.219999999999999 110.903 166.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.525 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -90.52 6.44 43.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.619 -0.882 . . . . 75.099999999999994 108.619 177.039 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.415 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 85.2 tttt -61.82 -53.5 55.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.564 -1.198 . . . . 74.219999999999999 110.248 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -69.41 -33.61 73.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.055 -0.52 . . . . 73.400000000000006 110.9 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.0 mtt -61.62 -38.93 89.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.608 0.718 . . . . 74.450000000000003 109.706 173.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.732 HD22 ' HE2' ' A' ' 70' ' ' MET . 22.6 tp -71.37 -46.07 61.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.687 -1.142 . . . . 74.140000000000001 110.786 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.96 -40.23 80.07 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.271 0.558 . . . . 75.409999999999997 110.486 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.54 -30.72 71.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.156 -0.929 . . . . 74.030000000000001 111.196 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -86.31 -29.26 23.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 74.019999999999996 110.508 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.573 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -61.26 -55.42 32.11 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.879 -0.415 . . . . 75.400000000000006 109.879 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.608 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 71.7 mm-40 -52.98 -30.63 36.16 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.515 -0.766 . . . . 65.420000000000002 111.799 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -54.52 -51.36 65.39 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.396 0.435 . . . . 72.219999999999999 111.133 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -80.22 -28.65 38.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.356 -0.384 . . . . 75.310000000000002 111.156 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.573 HG13 ' O ' ' B' ' 281' ' ' MET . 76.3 mt -63.98 -53.56 42.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.823 0.344 . . . . 60.329999999999998 110.895 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.9 pt-20 -63.18 -29.01 70.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.42 -0.355 . . . . 73.010000000000005 111.201 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . 0.448 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 61.6 m-80 -102.02 15.37 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.528 -0.305 . . . . 71.099999999999994 111.417 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.441 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 27.0 t80 -53.22 -57.6 9.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.683 0.278 . . . . 73.519999999999996 111.02 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -68.07 -21.76 64.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.297 -0.41 . . . . 70.150000000000006 110.583 -175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -65.06 -58.47 5.98 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.667 -0.494 . . . . 71.430000000000007 109.667 176.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -70.19 -35.98 74.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.02 0.438 . . . . 74.140000000000001 111.342 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.568 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 1.5 tmm_? -69.3 -19.85 63.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.056 -0.52 . . . . 73.129999999999995 110.53 -179.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -90.34 -34.29 15.76 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.66 0.267 . . . . 63.520000000000003 110.835 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 5.1 p -70.6 -22.45 62.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.323 -0.399 . . . . 62.049999999999997 111.222 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -88.73 149.29 23.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.16 -0.473 . . . . 72.209999999999994 110.347 175.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 67.4 mttm . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.671 -0.68 . . . . 74.239999999999995 110.175 -178.378 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 N--CA 1.475 0.821 0 CA-C-O 120.835 0.35 . . . . 62.409999999999997 110.408 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.418 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 5.8 m-20 -57.41 -44.69 84.8 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.288 -0.415 . . . . 73.310000000000002 111.023 177.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.672 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.3 p-10 -155.37 144.4 20.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.054 0.454 . . . . 71.140000000000001 110.767 -178.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -83.51 -80.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.993 -0.549 . . . . 74.019999999999996 110.169 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -105.16 -53.74 2.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.07 0.462 . . . . 74.430000000000007 109.94 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.672 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -82.52 161.9 22.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.895 -0.593 . . . . 71.200000000000003 110.808 177.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.473 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -80.41 55.14 2.19 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.895 -0.593 . . . . 73.420000000000002 112.181 -178.252 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -53.02 -42.65 65.86 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.334 -0.394 . . . . 74.329999999999998 111.844 -176.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' O ' HG21 ' A' ' 12' ' ' THR . . . -63.35 -28.39 69.97 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.136 0.421 . . . . 72.099999999999994 112.136 -176.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -80.81 -62.98 1.51 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 121.174 -0.21 . . . . 74.510000000000005 110.608 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.541 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.91 -22.41 10.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.778 0.659 . . . . 71.030000000000001 112.778 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.428 HG21 ' O ' ' A' ' 9' ' ' ALA . 1.9 t -70.02 -25.82 63.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.464 0.173 . . . . 72.120000000000005 110.992 -176.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.468 ' CB ' HD11 ' B' ' 217' ' ' LEU . 29.9 mt-10 -76.73 -35.5 57.74 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.373 0.606 . . . . 72.420000000000002 109.401 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.64 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.0 mm? -61.11 -49.81 75.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.612 -1.176 . . . . 74.340000000000003 109.694 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.705 HG23 ' HD1' ' B' ' 243' ' ' TYR . 91.2 mt -63.36 -39.84 86.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.616 -0.72 . . . . 72.219999999999999 110.858 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 tmmt? -62.02 -31.37 71.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.618 -0.719 . . . . 74.0 111.516 -176.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.508 HD11 HD12 ' B' ' 214' ' ' LEU . 3.0 tm? -64.68 -42.54 95.28 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.981 -0.748 . . . . 73.010000000000005 108.981 177.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.435 ' HB2' HG13 ' A' ' 32' ' ' VAL . . . -62.72 -30.79 71.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.403 -0.817 . . . . 73.439999999999998 110.948 -178.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.417 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -62.57 -35.26 78.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.212 -0.449 . . . . 75.310000000000002 110.749 179.437 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -70.57 -23.25 62.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.197 -0.456 . . . . 71.030000000000001 111.23 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -88.17 -27.29 21.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.247 0.546 . . . . 75.209999999999994 110.351 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.26 0.51 24.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 73.150000000000006 110.33 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 48.8 mt-30 -77.46 -11.81 59.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 75.019999999999996 111.197 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.449 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.8 t30 -66.04 114.14 4.98 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.462 -0.57 . . . . 75.109999999999999 109.462 178.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.8 t -77.45 58.06 1.64 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.318 -0.856 . . . . 75.150000000000006 112.272 -172.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -178.0 -22.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 75.230000000000004 111.441 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.449 HG13 ' HB3' ' A' ' 24' ' ' ASN . 9.7 mt -84.36 148.77 4.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 72.450000000000003 110.31 -177.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.685 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -72.76 145.38 47.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 74.519999999999996 109.704 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.0 m -63.39 -25.26 68.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.252 0.549 . . . . 75.340000000000003 109.843 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.03 -17.37 78.59 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 115.462 -0.79 . . . . 73.409999999999997 112.823 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.685 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 16.3 mm-40 -79.04 -22.62 45.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.417 0.627 . . . . 74.019999999999996 109.567 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.435 HG13 ' HB2' ' A' ' 18' ' ' ALA . 21.8 t -83.53 -42.44 17.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.417 -0.811 . . . . 74.329999999999998 110.088 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 p -62.1 -35.94 80.22 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.988 0.423 . . . . 73.140000000000001 110.177 176.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.13 -33.33 75.75 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.978 -0.555 . . . . 75.409999999999997 110.786 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.7 m -68.46 -36.35 78.88 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.509 -0.552 . . . . 72.519999999999996 109.509 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.64 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.7 t80 -69.94 -35.05 74.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.472 -0.785 . . . . 74.129999999999995 109.49 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.983 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.8 tpt -62.35 -56.79 14.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.08 -0.964 . . . . 73.030000000000001 110.563 179.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.406 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.637 -0.71 . . . . 74.319999999999993 111.335 177.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.42 ' HB3' HG13 ' B' ' 215' ' ' ILE . . . -62.36 -42.05 99.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.404 -0.362 . . . . 63.340000000000003 111.102 -179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.527 HD23 ' HE2' ' B' ' 237' ' ' MET . 52.1 tp -62.9 -38.51 91.25 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 110.021 -0.362 . . . . 74.219999999999999 110.021 176.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -61.71 -45.86 92.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.233 -0.439 . . . . 72.129999999999995 111.041 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.406 ' HG3' ' OD1' ' B' ' 280' ' ' ASN . 39.9 ttt180 -74.27 -18.69 60.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.383 -0.371 . . . . 74.319999999999993 110.923 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.496 ' HD2' HG22 ' B' ' 215' ' ' ILE . 14.2 t80 -90.57 -35.35 15.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.136 0.494 . . . . 75.25 110.346 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -74.85 -39.24 61.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.915 -0.584 . . . . 70.150000000000006 111.185 -175.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.482 ' HB2' ' HG2' ' B' ' 281' ' ' MET . . . -65.59 -18.21 65.15 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.035 0.445 . . . . 65.510000000000005 111.531 -178.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . 0.566 ' CH2' HG22 ' B' ' 229' ' ' THR . 16.7 t90 -63.67 -23.68 67.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.652 -0.703 . . . . 75.109999999999999 110.466 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.486 ' O ' HG21 ' A' ' 50' ' ' THR . 42.6 m-85 -93.61 9.71 35.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.219 -0.446 . . . . 74.140000000000001 111.075 178.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -76.74 -24.0 68.37 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.093 -1.051 . . . . 71.329999999999998 110.633 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.599 ' HA ' ' CE ' ' A' ' 58' ' ' MET . 14.8 m -72.38 -12.96 61.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.186 -0.507 . . . . 71.450000000000003 111.843 -177.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.486 HG21 ' O ' ' A' ' 47' ' ' PHE . 7.8 t -104.14 6.77 35.98 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.292 0.568 . . . . 75.099999999999994 110.612 -178.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.6 m -86.77 -24.78 24.96 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 112.935 0.717 . . . . 62.32 112.935 -175.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.507 ' HD1' ' H ' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -150.72 -172.31 4.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 122.095 -0.378 . . . . 63.049999999999997 111.22 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.507 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 9.6 pt-20 -110.85 -35.61 5.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.223 -0.444 . . . . 73.430000000000007 112.197 -173.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.3 p -115.15 155.56 26.9 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.094 -0.336 . . . . 71.010000000000005 110.094 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.612 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 21.9 ptmt -66.65 -37.93 85.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.738 0.304 . . . . 75.430000000000007 110.816 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -69.69 -27.67 65.21 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.07 -0.514 . . . . 73.120000000000005 111.32 -174.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.6 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.2 mt-30 -94.05 -32.47 13.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.448 -0.342 . . . . 74.549999999999997 110.652 178.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.728 ' HE2' HG12 ' B' ' 285' ' ' ILE . 16.6 ttp -72.57 -35.53 67.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.991 0.424 . . . . 74.010000000000005 110.497 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.559 ' HB2' HG21 ' B' ' 285' ' ' ILE . 35.2 tt0 -62.1 -37.55 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 75.140000000000001 110.654 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.69 -2.2 25.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.912 -0.585 . . . . 72.400000000000006 110.998 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 32.1 mmmt -110.81 0.39 17.26 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 116.32 -0.4 . . . . 74.230000000000004 110.953 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.748 ' HG3' ' H ' ' A' ' 63' ' ' GLN . 12.9 ptpt -54.97 -56.9 14.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.836 0.35 . . . . 73.099999999999994 110.367 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.748 ' H ' ' HG3' ' A' ' 62' ' ' LYS . 14.2 tp60 -74.49 -20.13 60.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.249 -0.432 . . . . 73.030000000000001 109.843 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -79.69 -36.26 37.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.754 -0.657 . . . . 74.340000000000003 111.434 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.482 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 20.8 ptp -79.27 -27.01 42.29 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.112 -1.069 . . . . 73.010000000000005 108.112 178.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.53 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 76.7 mtp -79.36 -17.46 54.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.864 -1.062 . . . . 74.439999999999998 110.477 175.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -58.56 -35.01 71.68 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.318 0.58 . . . . 53.219999999999999 110.819 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.733 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 14.8 p90 -108.92 -5.69 16.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.75 -0.659 . . . . 75.109999999999999 110.576 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.681 ' HD2' HD23 ' B' ' 277' ' ' LEU . 2.2 m-30 -60.52 -51.95 67.27 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 110.469 -0.197 . . . . 75.349999999999994 110.469 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 1.016 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.25 -43.36 70.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.629 0.728 . . . . 75.450000000000003 109.599 172.924 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.0 33.98 0.86 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.798 -1.092 . . . . 71.25 112.066 -171.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.733 ' HG3' ' O ' ' A' ' 68' ' ' TYR . 35.2 mtp180 -105.85 -43.2 4.94 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.626 -0.671 . . . . 71.140000000000001 110.958 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.806 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -91.57 6.93 43.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.817 -0.353 . . . . 74.239999999999995 111.127 -175.179 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.53 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 45.9 tttm -60.88 -53.16 60.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 74.200000000000003 110.461 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -57.52 -34.32 68.99 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.192 0.52 . . . . 73.420000000000002 110.882 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.8 mtt -68.28 -37.1 80.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 75.430000000000007 109.922 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.803 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 0.4 OUTLIER -73.0 -43.4 62.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.194 -0.912 . . . . 75.120000000000005 110.407 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -55.31 -39.02 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.449 0.643 . . . . 74.239999999999995 110.634 178.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.69 -22.49 53.88 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.121 -0.945 . . . . 75.409999999999997 112.269 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.478 ' OD1' ' HG3' ' B' ' 242' ' ' ARG . 20.2 m-80 -94.29 -8.67 38.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.446 -0.502 . . . . 74.219999999999999 111.854 -174.317 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.512 ' HE2' HD21 ' A' ' 77' ' ' LEU . 44.2 mtt -88.94 -175.24 4.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.216 0.532 . . . . 74.120000000000005 111.278 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.681 ' HA ' HD12 ' A' ' 85' ' ' ILE . 36.2 mt-10 69.8 -5.1 1.29 Allowed 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.668 -1.151 . . . . 62.020000000000003 113.207 177.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.02 -56.97 15.1 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.074 0.464 . . . . 74.329999999999998 110.703 178.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -73.78 -21.73 60.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 60.340000000000003 110.904 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.7 mt -67.52 -57.79 8.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.404 -0.362 . . . . 65.120000000000005 110.407 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.538 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 23.9 pt-20 -62.8 -26.43 68.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 72.140000000000001 111.292 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -98.49 1.45 46.67 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.996 0.369 . . . . 75.219999999999999 111.996 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -59.23 -40.57 86.29 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.981 -0.377 . . . . 71.230000000000004 109.981 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -51.3 -47.42 62.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.62 -0.718 . . . . 74.340000000000003 109.962 174.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -68.69 -53.04 24.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.191 -0.913 . . . . 74.109999999999999 110.911 -175.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -57.95 -43.8 86.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.156 0.503 . . . . 75.099999999999994 111.652 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -74.95 -11.09 60.04 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.757 -0.656 . . . . 74.519999999999996 110.609 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -96.06 -33.73 12.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.776 0.322 . . . . 71.329999999999998 111.17 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 16.4 p -73.16 -19.71 61.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.386 -0.37 . . . . 73.299999999999997 111.6 -178.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -90.76 169.57 10.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.152 -0.477 . . . . 70.230000000000004 110.429 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.3 mttm . . . . . 0 C--N 1.319 -0.755 0 CA-C-N 115.916 -0.583 . . . . 73.540000000000006 110.588 -174.877 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 C--O 1.233 0.221 0 CA-C-O 121.708 0.766 . . . . 74.400000000000006 109.825 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -141.95 172.44 12.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.085 -0.961 . . . . 71.510000000000005 109.213 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.562 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.0 p-10 -76.03 156.51 33.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 110.111 -0.329 . . . . 62.409999999999997 110.111 178.049 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -85.69 -113.49 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.418 -0.356 . . . . 72.439999999999998 110.512 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -91.89 -13.7 30.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.857 0.837 . . . . 75.219999999999999 109.184 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -107.55 150.44 26.85 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.101 -0.954 . . . . 64.010000000000005 110.471 176.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.442 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.1 OUTLIER -76.14 50.93 0.64 Allowed 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.939 -1.028 . . . . 72.530000000000001 112.486 -177.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.461 ' CZ ' ' HB1' ' B' ' 206' ' ' ALA . 63.5 m-85 -53.87 -44.28 70.26 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.725 0.298 . . . . 73.519999999999996 111.536 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -72.08 -9.04 57.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.147 -0.479 . . . . 74.129999999999995 111.86 -175.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.442 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 74.1 mtt180 -99.08 -59.31 1.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.928 -0.397 . . . . 75.430000000000007 109.928 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.652 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.12 -23.72 22.41 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.868 0.692 . . . . 72.510000000000005 112.868 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 9.3 t -65.05 -25.43 67.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.499 0.185 . . . . 74.439999999999998 111.499 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.458 ' HB2' HD12 ' A' ' 17' ' ' LEU . 39.1 mt-10 -80.52 -26.39 38.13 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.359 0.6 . . . . 61.210000000000001 109.845 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.652 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.2 mm? -68.18 -47.77 67.07 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.061 -0.972 . . . . 75.230000000000004 109.341 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.496 HG22 ' HD2' ' A' ' 43' ' ' TYR . 82.1 mt -66.5 -33.01 60.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-N 115.839 -0.619 . . . . 71.010000000000005 110.415 175.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.461 ' HE2' ' HB3' ' B' ' 216' ' ' LYS . 5.0 tmmm? -57.84 -36.37 72.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.529 -0.76 . . . . 73.349999999999994 110.797 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.468 HD11 ' CB ' ' A' ' 13' ' ' GLU . 2.5 tm? -66.95 -41.68 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.668 -0.493 . . . . 74.25 109.668 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.39 -31.74 69.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 64.549999999999997 110.94 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -33.32 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.141 -0.481 . . . . 70.329999999999998 111.12 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.06 -24.75 47.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.126 -0.488 . . . . 72.209999999999994 111.764 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -91.01 -17.06 26.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.395 0.617 . . . . 74.319999999999993 110.114 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -85.92 8.79 18.98 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.259 -0.882 . . . . 74.129999999999995 110.257 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -84.18 10.05 11.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.947 -0.569 . . . . 71.540000000000006 111.217 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.407 HD21 ' CG ' ' B' ' 226' ' ' GLU . 0.8 OUTLIER -88.41 108.27 19.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.955 0.407 . . . . 73.209999999999994 110.763 177.83 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -74.39 -25.23 59.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.725 -0.671 . . . . 70.040000000000006 110.885 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . 0.407 ' CG ' HD21 ' B' ' 224' ' ' ASN . 11.1 pt-20 -82.2 -6.0 58.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.355 -0.384 . . . . 74.510000000000005 111.781 -176.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.785 HG22 ' H ' ' B' ' 228' ' ' GLN . 2.4 mt -124.12 179.7 2.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.84 -0.43 . . . . 74.129999999999995 109.84 -178.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.785 ' H ' HG22 ' B' ' 227' ' ' ILE . 2.3 mp0 -103.82 158.39 16.42 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.822 -0.436 . . . . 71.140000000000001 109.822 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 229' ' ' THR . . . . . 0.566 HG22 ' CH2' ' A' ' 46' ' ' TRP . 25.4 m -67.08 -16.44 64.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.212 0.53 . . . . 72.420000000000002 110.656 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -62.85 -33.36 86.78 Favored Glycine 0 CA--C 1.521 0.449 0 CA-C-N 115.603 -0.726 . . . . 75.109999999999999 113.733 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -72.45 -26.89 62.0 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 117.573 0.687 . . . . 74.519999999999996 110.6 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.7 t -72.06 -46.76 57.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.138 -0.483 . . . . 75.200000000000003 110.129 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 3.2 p -62.49 -34.52 77.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 73.209999999999994 110.366 176.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -69.81 -35.9 75.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.912 -0.585 . . . . 72.530000000000001 111.255 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 59.8 m -67.04 -35.38 79.74 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.09 0.471 . . . . 73.150000000000006 109.889 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.574 ' CD1' HD13 ' A' ' 14' ' ' LEU . 8.5 t80 -67.47 -38.71 84.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.734 -0.666 . . . . 64.340000000000003 109.69 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.806 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.6 ttm -65.97 -48.22 71.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.539 -0.755 . . . . 72.140000000000001 111.42 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.473 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 17.3 t-105 -61.15 -40.53 94.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 74.109999999999999 110.463 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.562 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.76 -42.16 99.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.882 -0.599 . . . . 74.239999999999995 110.997 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.716 HD23 ' SD ' ' A' ' 37' ' ' MET . 49.6 tp -60.75 -40.52 92.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 72.0 110.741 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.4 95.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.099 -0.501 . . . . 64.010000000000005 110.671 178.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . 0.478 ' HG3' ' OD1' ' A' ' 80' ' ' ASN . 64.3 ttt180 -67.08 -32.57 73.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.572 -0.74 . . . . 74.420000000000002 110.608 -179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.705 ' HD1' HG23 ' A' ' 15' ' ' ILE . 23.0 t80 -77.52 -40.06 44.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 72.099999999999994 110.992 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -73.2 -24.49 60.53 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.772 0.286 . . . . 74.420000000000002 111.772 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . 0.465 ' HB1' HD23 ' A' ' 77' ' ' LEU . . . -68.55 -19.77 64.51 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.247 0.546 . . . . 74.400000000000006 110.958 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.1 t90 -59.88 -33.46 71.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.241 -0.89 . . . . 64.239999999999995 111.054 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -72.84 -6.52 45.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.854 -0.612 . . . . 75.340000000000003 112.502 -171.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.481 ' O ' ' HE1' ' B' ' 258' ' ' MET . . . -59.8 -30.99 70.47 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.011 -1.09 . . . . 73.140000000000001 110.916 172.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 6.6 m -66.36 -16.29 63.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.724 0.41 . . . . 74.140000000000001 111.741 -177.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -116.43 17.33 15.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.067 0.46 . . . . 75.310000000000002 110.808 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 39.8 t -81.34 -56.55 3.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.031 -0.531 . . . . 72.239999999999995 110.655 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.579 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 5.2 m-85 -137.69 178.76 6.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.083 0.468 . . . . 74.340000000000003 112.188 -177.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -94.76 -33.75 12.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.36 -0.836 . . . . 75.209999999999994 110.985 -173.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.417 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 75.4 p -114.21 154.34 28.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.242 -0.435 . . . . 72.349999999999994 110.211 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.489 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 21.3 ptmt -70.03 -29.8 66.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.816 0.341 . . . . 74.439999999999998 110.292 -178.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . 0.417 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.9 mp0 -55.17 -48.43 73.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.685 -0.689 . . . . 65.340000000000003 110.415 177.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.69 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.4 mt-30 -80.54 -41.82 23.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.73 -0.668 . . . . 75.420000000000002 109.986 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.489 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 23.1 ttt -55.18 -44.51 75.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.602 -0.726 . . . . 74.109999999999999 111.483 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.542 ' HA ' HD11 ' A' ' 85' ' ' ILE . 36.0 tt0 -64.75 -40.98 96.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.515 . . . . 73.140000000000001 111.432 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.74 -5.96 33.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 72.329999999999998 111.685 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.69 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 27.6 mmmt -106.75 4.73 27.98 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.247 -0.279 . . . . 72.450000000000003 110.247 -177.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.461 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.6 ptpt -51.38 -46.0 62.66 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.431 0.457 . . . . 74.5 110.788 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.461 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 11.3 tp60 -84.27 -18.03 37.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.766 0.317 . . . . 75.329999999999998 110.521 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . 0.447 ' CD ' ' HZ1' ' B' ' 261' ' ' LYS . 49.4 mt-10 -85.24 -30.56 23.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.525 . . . . 70.540000000000006 111.26 -177.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.476 ' HG3' ' HE1' ' A' ' 81' ' ' MET . 23.3 ptp -81.75 -29.0 33.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.342 -0.984 . . . . 74.019999999999996 108.342 175.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.803 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 71.9 mtp -87.87 11.23 16.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.864 -1.062 . . . . 75.439999999999998 110.462 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -75.0 -38.03 61.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 74.319999999999993 111.027 -177.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.594 ' HA ' ' OD2' ' B' ' 271' ' ' ASP . 42.7 p90 -114.07 -4.21 13.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.884 -0.598 . . . . 71.340000000000003 110.818 -175.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -56.68 -52.46 64.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 121.02 -0.272 . . . . 73.420000000000002 110.607 -178.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 1.016 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.55 -50.85 52.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.619 0.574 . . . . 71.329999999999998 110.888 177.773 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . 0.594 ' OD2' ' HA ' ' B' ' 268' ' ' TYR . 2.9 p30 -85.47 22.07 1.63 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.643 . . . . 74.129999999999995 112.647 -171.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.561 ' HB2' ' HE3' ' A' ' 37' ' ' MET . 33.3 mtp180 -82.03 -34.98 29.29 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.539 -0.464 . . . . 75.540000000000006 110.259 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.983 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.7 12.93 34.14 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.445 -0.502 . . . . 74.140000000000001 109.75 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.811 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 86.5 tttt -58.49 -54.87 42.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.726 -0.67 . . . . 74.150000000000006 110.261 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.38 -31.76 72.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.573 -0.739 . . . . 74.349999999999994 111.281 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 58.2 mtt -71.49 -36.28 71.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.927 -0.579 . . . . 71.209999999999994 110.389 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.681 HD23 ' HD2' ' A' ' 69' ' ' TYR . 38.0 tp -70.35 -41.21 73.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.292 -0.867 . . . . 74.209999999999994 110.127 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.476 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 11.1 t70 -60.9 -45.26 95.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.782 -0.644 . . . . 75.430000000000007 110.408 178.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -66.26 -17.08 64.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.239 -0.891 . . . . 71.140000000000001 112.235 -176.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . 0.406 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 36.4 m-80 -102.13 -2.08 30.14 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.879 -0.328 . . . . 73.299999999999997 111.392 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.482 ' HG2' ' HB2' ' A' ' 45' ' ' ALA . 46.2 mtt -91.54 -177.25 4.75 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.862 -0.335 . . . . 73.319999999999993 110.428 174.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.701 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 46.1 mt-10 67.38 -3.36 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.67 -0.696 . . . . 72.239999999999995 112.598 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.29 -58.75 5.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.07 0.462 . . . . 74.439999999999998 110.398 176.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -84.96 -3.13 58.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.778 -0.646 . . . . 74.420000000000002 110.996 177.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.728 HG12 ' HE2' ' A' ' 58' ' ' MET . 63.1 mt -85.01 -59.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.724 0.297 . . . . 73.120000000000005 110.437 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -67.11 -18.44 65.31 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.968 0.413 . . . . 73.329999999999998 110.561 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -107.01 6.92 29.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 111.011 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.612 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 60.7 t80 -59.19 -48.89 79.93 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.852 -0.425 . . . . 74.510000000000005 109.852 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -63.87 -31.51 72.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.566 -0.743 . . . . 51.399999999999999 110.443 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -66.78 -56.83 8.69 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.78 -0.645 . . . . 71.430000000000007 110.29 177.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . 0.477 ' O ' ' HG2' ' B' ' 295' ' ' GLN . 62.5 m-85 -64.83 -40.77 95.73 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.915 0.388 . . . . 75.209999999999994 110.979 -176.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.592 ' HB2' ' O ' ' B' ' 288' ' ' PHE . 0.2 OUTLIER -67.64 -18.32 64.91 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.862 -0.608 . . . . 74.439999999999998 110.94 -178.248 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -95.55 -29.86 14.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.226 -0.443 . . . . 71.019999999999996 111.078 -179.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 16.7 p -75.55 -10.22 59.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.052 0.453 . . . . 75.340000000000003 111.234 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' B' ' 291' ' ' TYR . 10.7 pt20 -117.73 171.21 8.19 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.971 -0.559 . . . . 73.140000000000001 109.981 176.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 68.4 mttm . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.416 -0.802 . . . . 74.439999999999998 109.823 -177.136 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.3 p . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 121.248 0.547 . . . . 74.439999999999998 110.861 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -124.51 -66.16 1.0 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.825 -0.625 . . . . 74.219999999999999 109.453 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.4 p-10 -158.21 136.56 10.94 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.422 -0.955 . . . . 61.149999999999999 108.422 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -84.14 -66.06 0.94 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.732 0.301 . . . . 71.209999999999994 111.416 -174.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -124.22 -41.44 2.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.457 -0.571 . . . . 74.239999999999995 109.457 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.76 157.25 31.79 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.551 -0.75 . . . . 74.540000000000006 110.635 177.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.482 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.31 43.41 0.72 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.092 -0.958 . . . . 64.120000000000005 112.468 -175.122 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -52.48 -51.42 59.44 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.885 0.374 . . . . 73.439999999999998 111.589 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.35 -5.57 24.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 74.319999999999993 111.759 -177.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.482 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 27.6 mmt180 -100.72 -58.88 1.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.313 -0.254 . . . . 75.530000000000001 110.313 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.698 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -52.19 -25.54 9.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.462 0.542 . . . . 63.240000000000002 112.462 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -62.89 -24.77 67.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.61 -0.268 . . . . 74.519999999999996 111.062 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.554 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.0 mt-10 -86.24 -28.96 23.5 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-O 121.108 0.48 . . . . 73.510000000000005 110.024 -178.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.698 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -64.26 -47.15 80.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.587 -0.733 . . . . 74.519999999999996 109.613 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.452 HG13 ' HB3' ' B' ' 239' ' ' ALA . 62.0 mt -69.51 -28.45 37.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.931 -0.577 . . . . 75.010000000000005 110.275 176.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 13' ' ' GLU . 2.7 mmmt -63.91 -28.69 70.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.543 . . . . 74.329999999999998 111.296 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.614 HD11 HD12 ' B' ' 214' ' ' LEU . 2.7 tm? -78.27 -31.13 48.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.259 -0.645 . . . . 74.120000000000005 109.259 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.75 -44.06 74.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.719 -0.673 . . . . 71.319999999999993 109.404 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.493 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 6.5 m-20 -58.21 -27.66 64.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.27 -0.877 . . . . 73.310000000000002 110.643 175.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -75.27 -32.39 61.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 75.239999999999995 110.813 -176.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -86.24 -20.4 28.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.426 0.632 . . . . 74.239999999999995 109.75 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.09 -10.05 59.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.142 -0.935 . . . . 73.409999999999997 109.574 176.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 80.3 mt-30 -77.48 -10.29 59.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.557 -0.747 . . . . 73.439999999999998 110.799 177.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.588 HD21 HG13 ' A' ' 27' ' ' ILE . 2.1 t30 -71.26 103.9 2.97 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.076 -0.713 . . . . 75.230000000000004 109.076 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -46.8 -44.73 19.45 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.528 0.936 . . . . 72.120000000000005 113.528 -173.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.57 -4.02 54.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.321 0.489 . . . . 74.540000000000006 112.321 -173.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.588 HG13 HD21 ' A' ' 24' ' ' ASN . 7.6 mt -104.0 151.4 6.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.649 -0.5 . . . . 71.140000000000001 109.649 177.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -98.97 160.15 14.46 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.177 -0.465 . . . . 74.049999999999997 110.382 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.08 -33.4 65.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.935 -0.575 . . . . 71.109999999999999 110.744 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.74 -33.65 83.55 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.484 -0.78 . . . . 75.019999999999996 113.828 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -74.63 -26.25 59.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.734 0.767 . . . . 74.099999999999994 110.365 -174.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -76.16 -32.84 23.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.671 -0.695 . . . . 75.040000000000006 110.305 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.564 ' O ' ' HG3' ' A' ' 37' ' ' MET . 92.1 p -72.4 -12.59 61.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.293 -0.412 . . . . 70.299999999999997 110.258 177.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -90.86 -39.72 12.16 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.121 -0.491 . . . . 73.230000000000004 110.798 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.447 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 5.6 p -67.41 -31.01 70.93 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.162 0.506 . . . . 74.340000000000003 110.276 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.642 ' HB3' HD11 ' B' ' 240' ' ' LEU . 2.6 t80 -68.52 -29.38 67.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 71.349999999999994 110.378 178.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.674 ' HG2' HD21 ' B' ' 240' ' ' LEU . 51.0 mtp -77.52 -45.69 24.71 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.719 -0.219 . . . . 75.340000000000003 110.635 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.0 t-105 -60.67 -38.92 86.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 74.439999999999998 110.138 176.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.47 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -64.49 -47.89 77.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.584 -0.735 . . . . 63.119999999999997 110.926 177.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.615 HD21 ' HG2' ' B' ' 237' ' ' MET . 51.2 tp -63.25 -40.5 97.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.714 0.292 . . . . 73.420000000000002 110.514 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.504 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -54.69 -46.68 74.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.765 -0.652 . . . . 51.119999999999997 111.496 -178.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -13.13 51.35 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.211 -0.595 . . . . 74.439999999999998 110.97 -177.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -80.94 -35.08 32.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.028 -0.73 . . . . 73.109999999999999 109.028 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -67.73 -35.13 78.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.888 -0.596 . . . . 73.010000000000005 109.535 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.541 ' HA ' ' CE ' ' B' ' 281' ' ' MET . . . -71.83 -17.81 62.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.656 -0.702 . . . . 72.109999999999999 111.529 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.2 t90 -63.4 -22.54 66.94 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.17 0.51 . . . . 75.109999999999999 110.224 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -89.32 -4.07 58.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 71.040000000000006 111.373 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.51 ' C ' ' HE3' ' A' ' 58' ' ' MET . . . -71.99 -37.69 60.27 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.603 -0.808 . . . . 34.439999999999998 112.124 -179.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 33.5 p -67.48 -23.18 65.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.895 0.379 . . . . 74.109999999999999 111.441 -176.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.9 t -100.19 11.28 39.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.15 0.5 . . . . 73.219999999999999 110.278 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 t -85.88 -29.53 23.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.422 -0.354 . . . . 62.009999999999998 110.685 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.83 ' HE2' ' HE3' ' A' ' 61' ' ' LYS . 0.3 OUTLIER -145.46 -175.21 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.208 0.447 . . . . 74.439999999999998 112.208 -179.721 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.534 ' HG3' HG22 ' A' ' 54' ' ' THR . 10.7 pt-20 -99.1 -32.28 11.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.418 -0.81 . . . . 73.310000000000002 112.162 -172.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.534 HG22 ' HG3' ' A' ' 53' ' ' GLU . 67.6 p -128.59 156.79 42.8 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 116.241 -0.436 . . . . 65.040000000000006 109.911 -178.096 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.607 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.6 ptmm? -69.05 -27.52 65.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.842 0.353 . . . . 74.420000000000002 110.641 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -63.45 -49.15 74.79 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.875 -0.602 . . . . 74.400000000000006 110.294 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.625 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -79.71 -36.97 36.69 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.813 -0.63 . . . . 75.310000000000002 110.31 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.563 ' HE1' HG12 ' B' ' 285' ' ' ILE . 14.3 ttt -60.2 -40.42 90.03 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.04 -0.527 . . . . 62.539999999999999 111.219 178.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.662 ' HA ' HD11 ' B' ' 285' ' ' ILE . 35.3 tt0 -63.7 -30.86 71.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.027 -0.533 . . . . 73.140000000000001 111.231 -177.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.67 -9.23 59.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.04 0.448 . . . . 63.439999999999998 111.042 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.83 ' HE3' ' HE2' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -105.0 -5.46 20.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.213 -0.449 . . . . 75.450000000000003 110.338 -176.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 63' ' ' GLN . 0.6 OUTLIER -51.86 -54.91 23.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 72.400000000000006 110.866 -177.603 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.5 ' N ' ' HD2' ' A' ' 62' ' ' LYS . 11.0 tp60 -75.31 -13.13 60.4 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.098 -0.501 . . . . 75.409999999999997 110.687 -175.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -87.55 -32.87 19.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.477 -0.328 . . . . 73.329999999999998 111.032 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.7 ptp -81.79 -26.73 34.17 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.497 -0.927 . . . . 64.030000000000001 108.497 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.652 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 71.6 mtp -83.3 -9.85 58.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.054 -0.975 . . . . 64.219999999999999 110.508 175.048 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 30.1 t70 -66.53 -18.13 65.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.996 -0.547 . . . . 73.120000000000005 111.153 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.494 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 26.6 p90 -124.63 -0.69 8.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.048 -0.524 . . . . 75.239999999999995 110.637 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.58 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 1.5 m-30 -66.79 -56.85 8.61 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 121.352 -0.139 . . . . 72.409999999999997 111.045 -178.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.925 ' HE1' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -46.55 -54.26 9.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.122 0.487 . . . . 74.230000000000004 110.363 174.812 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -81.6 17.42 1.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.803 -0.635 . . . . 63.509999999999998 111.771 -174.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.58 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -85.09 -50.2 7.63 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.028 0.442 . . . . 75.549999999999997 110.416 -177.485 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.572 ' HB3' ' HB3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -89.86 10.55 23.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.428 0.633 . . . . 75.230000000000004 109.646 -174.697 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.598 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 82.2 tttt -60.96 -49.73 76.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.069 -0.969 . . . . 74.230000000000004 110.735 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -58.95 -41.98 88.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 74.25 110.906 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 54.0 mtt -64.28 -36.45 84.13 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.653 -0.703 . . . . 73.430000000000007 110.354 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 2.3 tt -74.55 -44.88 48.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.326 -0.852 . . . . 75.299999999999997 110.353 -176.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.595 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 14.1 t70 -60.64 -38.74 85.8 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.327 0.584 . . . . 72.140000000000001 110.313 178.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.16 -24.64 66.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.196 -0.911 . . . . 74.239999999999995 111.668 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -99.4 -20.68 16.35 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.74 -0.384 . . . . 75.099999999999994 110.429 -178.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.524 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 16.5 mmt -61.67 -63.85 1.13 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.079 -0.51 . . . . 75.200000000000003 110.503 174.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.586 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 35.7 mt-10 -71.53 -7.34 47.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.074 -0.512 . . . . 75.239999999999995 111.479 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.89 -46.24 75.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.711 -0.477 . . . . 72.019999999999996 109.711 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -73.3 -35.64 66.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.05 -0.523 . . . . 74.430000000000007 110.268 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.586 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 86.5 mt -61.49 -54.27 37.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.853 -0.612 . . . . 75.25 111.655 -178.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.557 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.2 pt-20 -63.9 -19.56 65.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.822 0.344 . . . . 75.0 111.355 -177.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -104.95 6.87 33.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.466 -0.333 . . . . 74.239999999999995 111.093 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.461 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 84.3 t80 -60.97 -38.75 87.06 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.468 -0.567 . . . . 71.430000000000007 109.468 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.65 -45.75 81.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.325 -0.852 . . . . 52.520000000000003 109.347 175.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -62.81 -54.23 42.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.096 -0.956 . . . . 73.120000000000005 110.912 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -63.73 -35.42 80.51 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.84 0.311 . . . . 74.310000000000002 111.84 -177.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -73.45 -14.09 61.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.993 0.425 . . . . 75.230000000000004 110.628 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -93.96 -30.76 14.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.296 -0.411 . . . . 71.450000000000003 110.862 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 20.9 p -79.16 -4.88 52.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.343 0.592 . . . . 74.329999999999998 110.769 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -121.27 176.4 5.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.654 -0.703 . . . . 75.129999999999995 110.202 175.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt . . . . . 0 C--N 1.321 -0.669 0 CA-C-N 115.844 -0.616 . . . . 72.540000000000006 110.329 179.844 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 25.2 m . . . . . 0 C--O 1.235 0.327 0 CA-C-O 120.912 0.387 . . . . 72.340000000000003 110.526 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -123.39 154.87 38.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 110.18 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.694 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.3 OUTLIER -100.35 147.77 25.43 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.624 -0.51 . . . . 74.510000000000005 109.624 176.619 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . 0.922 ' HG2' ' HE2' ' B' ' 208' ' ' TYR . 1.6 pm0 -60.52 -88.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.139 0.422 . . . . 72.430000000000007 112.139 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -112.26 -40.37 4.18 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.437 -0.505 . . . . 75.319999999999993 110.957 -178.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -81.69 156.66 24.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.176 -0.465 . . . . 73.030000000000001 111.147 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.447 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -76.92 53.4 0.93 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.228 -0.896 . . . . 74.230000000000004 112.259 -178.949 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.922 ' HE2' ' HG2' ' B' ' 204' ' ' GLU . 63.3 m-85 -55.45 -44.25 76.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.71 0.291 . . . . 75.129999999999995 111.314 -178.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.54 -20.46 64.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.073 -0.512 . . . . 42.539999999999999 111.925 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -91.44 -62.58 1.4 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.104 -0.239 . . . . 74.439999999999998 110.686 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.695 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -53.74 -24.06 13.77 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.802 0.667 . . . . 73.439999999999998 112.802 -176.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 11.8 t -65.0 -28.09 69.27 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.672 0.272 . . . . 72.400000000000006 111.161 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.499 ' HB2' HD12 ' A' ' 17' ' ' LEU . 48.3 mt-10 -82.32 -25.23 34.1 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.331 0.586 . . . . 74.010000000000005 109.897 -176.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.695 HD22 ' HA ' ' B' ' 211' ' ' ALA . 3.3 mm? -67.04 -44.65 79.69 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.282 -0.872 . . . . 75.109999999999999 108.985 178.149 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.47 HG13 ' HB2' ' A' ' 39' ' ' ALA . 78.1 mt -73.07 -30.45 31.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.494 -0.775 . . . . 74.430000000000007 110.407 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 39.4 tptt -53.58 -45.53 70.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.765 -0.652 . . . . 75.409999999999997 111.344 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.2 tm? -64.31 -40.01 95.06 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.757 -0.461 . . . . 75.340000000000003 109.757 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -62.13 -27.01 68.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 75.439999999999998 110.973 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.481 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 94.7 m-20 -66.58 -31.68 72.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 63.240000000000002 110.65 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . 0.441 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -74.09 -32.24 63.15 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.746 0.308 . . . . 72.340000000000003 111.338 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -82.18 -15.82 51.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.148 0.499 . . . . 72.140000000000001 110.546 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -78.73 -16.08 57.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.839 -0.619 . . . . 65.109999999999999 109.712 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 59.6 mm-40 -85.5 -10.55 55.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.643 -0.708 . . . . 73.109999999999999 109.813 177.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.722 ' ND2' ' HG2' ' B' ' 226' ' ' GLU . 1.8 t30 -71.55 114.53 9.73 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.147 -0.933 . . . . 74.310000000000002 110.141 -175.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -58.96 -31.61 68.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.47 -0.786 . . . . 72.409999999999997 112.998 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . 0.722 ' HG2' ' ND2' ' B' ' 224' ' ' ASN . 12.0 pt-20 -82.69 -7.64 59.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.738 0.304 . . . . 74.049999999999997 111.383 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.57 ' CG2' ' HB2' ' B' ' 231' ' ' GLU . 4.5 mt -113.15 149.12 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.010000000000005 110.419 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -102.68 164.2 11.78 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.534 -0.543 . . . . 70.219999999999999 109.534 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 2.3 m -54.62 -38.51 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.965 0.412 . . . . 74.299999999999997 111.387 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -77.63 -8.74 87.16 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.121 -0.562 . . . . 64.099999999999994 113.663 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.57 ' HB2' ' CG2' ' B' ' 227' ' ' ILE . 5.8 mm-40 -88.72 -33.32 17.56 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.564 0.682 . . . . 72.109999999999999 109.539 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.2 t -71.81 -38.81 66.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.400000000000006 110.272 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 21.4 p -63.5 -43.05 98.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 64.510000000000005 110.4 178.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -70.99 -26.6 63.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.582 . . . . 70.010000000000005 110.866 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.426 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.5 t -66.55 -33.69 76.24 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.562 0.696 . . . . 75.140000000000001 109.158 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.595 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 5.7 t80 -73.38 -28.55 62.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.111 -0.949 . . . . 74.140000000000001 109.842 177.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.615 ' HG2' HD21 ' A' ' 40' ' ' LEU . 51.7 mtp -75.64 -46.19 32.96 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.368 -0.378 . . . . 74.129999999999995 110.611 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.41 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 27.2 t-105 -60.85 -40.35 92.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.089 0.471 . . . . 63.240000000000002 110.166 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.452 ' HB3' HG13 ' A' ' 15' ' ' ILE . . . -62.54 -45.56 92.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.609 -0.723 . . . . 72.239999999999995 110.81 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.674 HD21 ' HG2' ' A' ' 37' ' ' MET . 52.1 tp -67.82 -38.41 83.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.895 0.379 . . . . 74.439999999999998 110.511 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.559 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -56.87 -49.58 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.794 -0.639 . . . . 73.150000000000006 111.472 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -86.78 6.37 31.85 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.072 -0.651 . . . . 72.319999999999993 110.887 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -99.63 -36.66 9.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.838 -0.801 . . . . 71.129999999999995 108.838 172.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.35 -39.02 85.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.822 -0.626 . . . . 73.340000000000003 109.575 173.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . 0.524 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -67.21 -16.55 64.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.614 -0.721 . . . . 72.409999999999997 111.732 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -58.86 -34.97 72.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 74.439999999999998 110.858 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -76.53 -2.94 34.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 71.230000000000004 111.777 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -67.27 -30.08 75.07 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.55 -0.833 . . . . 61.200000000000003 111.26 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.0 p -63.89 -22.18 66.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.954 0.407 . . . . 73.140000000000001 111.262 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.9 t -111.91 18.27 18.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.325 -0.398 . . . . 73.519999999999996 110.73 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 9.7 t -81.32 -39.79 24.61 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.771 -0.455 . . . . 71.5 109.771 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.853 ' HE2' ' HE3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -149.17 -174.63 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 74.010000000000005 111.213 179.153 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' B' ' 254' ' ' THR . 12.9 pt-20 -90.34 -50.84 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.774 -0.648 . . . . 74.209999999999994 112.061 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.464 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 80.6 p -107.56 164.06 12.54 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 110.444 -0.206 . . . . 74.129999999999995 110.444 -176.393 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.522 ' HB2' HG22 ' A' ' 85' ' ' ILE . 22.6 ptmt -65.61 -33.48 76.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.766 0.317 . . . . 74.319999999999993 110.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.18 -45.8 83.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.99 -0.55 . . . . 75.230000000000004 111.072 -177.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -87.66 -7.11 57.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.134 -0.485 . . . . 72.129999999999995 111.21 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 9.9 ttt -93.29 -41.5 9.83 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.318 0.58 . . . . 75.209999999999994 109.959 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.556 ' HA ' HD11 ' A' ' 85' ' ' ILE . 44.4 tt0 -56.27 -42.48 77.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.199 -0.909 . . . . 74.439999999999998 111.171 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.29 -5.73 24.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.459 -0.791 . . . . 65.150000000000006 111.83 -176.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.853 ' HE3' ' HE2' ' B' ' 252' ' ' PHE . 0.1 OUTLIER -109.93 5.24 22.24 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.434 -0.348 . . . . 74.129999999999995 110.65 -175.696 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 13.5 ptpt -51.04 -47.59 61.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 71.430000000000007 111.399 -178.01 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.596 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 12.4 tp60 -78.89 -11.97 60.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.566 -0.288 . . . . 73.230000000000004 111.05 -173.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . 0.509 ' CD ' ' HZ1' ' B' ' 261' ' ' LYS . 36.7 mt-10 -83.89 -43.23 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.669 -0.241 . . . . 75.420000000000002 111.294 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.433 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.7 ptt? -76.81 -30.03 56.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.77 -0.772 . . . . 75.319999999999993 109.382 176.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.595 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 62.4 mtp -88.39 16.39 6.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.805 -0.634 . . . . 73.099999999999994 110.41 177.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . 0.468 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 20.7 t70 -90.01 -36.49 14.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.136 0.493 . . . . 74.439999999999998 109.696 175.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -107.72 -14.53 14.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.983 -0.553 . . . . 72.329999999999998 111.544 -174.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.454 ' O ' ' HE3' ' A' ' 37' ' ' MET . 5.1 m-30 -57.17 -60.72 3.18 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 121.018 -0.273 . . . . 75.430000000000007 110.533 178.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.854 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.07 -45.39 52.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.645 0.736 . . . . 62.340000000000003 110.181 175.935 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -84.26 9.01 14.04 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.088 -0.96 . . . . 74.040000000000006 112.052 -170.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 2.9 mtm180 -88.39 -41.4 12.84 Favored 'General case' 0 CA--C 1.513 -0.453 0 O-C-N 121.834 -0.541 . . . . 73.209999999999994 110.648 -176.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.555 ' HB3' ' HB3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -94.79 7.48 45.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.509 0.671 . . . . 73.310000000000002 109.268 -175.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.925 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 79.5 tttt -61.54 -57.16 13.2 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.688 -1.142 . . . . 75.439999999999998 111.14 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.4 -32.6 74.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.703 0.287 . . . . 74.329999999999998 110.882 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 63.8 mtt -60.93 -41.12 95.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.481 0.658 . . . . 75.319999999999993 109.509 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.652 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 0.9 OUTLIER -69.49 -41.87 75.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.147 -0.933 . . . . 70.329999999999998 109.73 179.08 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.76 -41.45 86.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.543 -0.753 . . . . 72.200000000000003 110.611 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.9 -20.87 59.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.255 -0.884 . . . . 75.319999999999993 112.034 -177.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -92.25 -24.68 18.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.676 -0.41 . . . . 72.120000000000005 110.556 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.588 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 18.3 mmt -58.98 -59.3 5.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.916 -0.584 . . . . 74.310000000000002 110.69 174.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.592 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.9 mt-10 -63.57 -20.99 66.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.595 -0.73 . . . . 75.340000000000003 112.336 -174.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.92 -48.72 77.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.176 0.512 . . . . 71.299999999999997 110.139 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -77.07 -25.32 52.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.005 -0.543 . . . . 74.219999999999999 110.445 178.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.662 HD11 ' HA ' ' A' ' 59' ' ' GLN . 63.4 mt -71.03 -56.31 11.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.095 -0.502 . . . . 73.209999999999994 111.279 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -64.4 -28.21 69.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.739 0.304 . . . . 74.530000000000001 111.64 -176.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -91.71 3.21 55.63 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.99 -0.284 . . . . 72.25 111.087 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.607 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 80.4 t80 -59.14 -39.78 83.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.85 -0.159 . . . . 74.349999999999994 110.935 -179.388 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -58.91 -31.57 68.75 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.079 0.466 . . . . 71.010000000000005 110.212 178.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -74.72 -49.27 21.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.776 -0.647 . . . . 73.120000000000005 109.75 176.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -60.09 -39.38 85.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.915 -0.584 . . . . 74.219999999999999 111.455 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -72.29 -15.6 61.9 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.993 -0.549 . . . . 73.230000000000004 110.681 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.57 -29.35 16.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.951 0.405 . . . . 62.240000000000002 111.034 -178.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 10.1 p -80.21 -15.09 57.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.132 0.491 . . . . 71.530000000000001 111.415 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -111.89 170.52 8.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.146 -0.479 . . . . 72.409999999999997 110.906 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . 0.467 ' HZ3' ' HB2' ' B' ' 296' ' ' LYS . 10.3 mtmp? . . . . . 0 C--O 1.251 1.152 0 CA-C-N 115.309 -0.86 . . . . 73.239999999999995 109.62 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.473 0.706 0 CA-C-O 121.067 0.461 . . . . 74.25 110.209 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -132.02 163.43 28.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.981 -0.554 . . . . 75.239999999999995 109.784 -177.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.5 p-10 -97.28 145.79 25.75 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.844 0.354 . . . . 74.209999999999994 110.178 -178.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -79.5 -86.37 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.416 -0.587 . . . . 75.349999999999994 109.416 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -113.09 -42.71 3.49 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.765 -0.828 . . . . 71.420000000000002 108.765 170.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -71.81 154.12 41.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.271 -0.877 . . . . 75.040000000000006 111.972 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.486 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -77.77 57.07 1.6 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.239 -1.346 . . . . 74.310000000000002 111.954 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.412 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 67.3 m-85 -54.75 -40.91 69.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.315 -0.402 . . . . 73.319999999999993 111.802 -178.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.74 -16.18 61.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 72.200000000000003 111.655 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -87.33 -60.91 1.84 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.532 -0.304 . . . . 74.129999999999995 110.389 176.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.745 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -61.53 -16.74 50.5 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.887 0.699 . . . . 75.510000000000005 112.887 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.538 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 14.7 t -65.05 -30.44 71.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.035 -0.266 . . . . 64.540000000000006 111.016 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.498 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.2 mt-10 -81.6 -26.36 34.96 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.167 0.508 . . . . 74.430000000000007 110.151 -176.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.745 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.6 mm? -63.6 -41.67 98.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.543 -0.753 . . . . 75.329999999999998 109.804 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.491 HG23 ' HD2' ' B' ' 243' ' ' TYR . 69.1 mt -72.71 -22.74 20.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.609 -0.723 . . . . 72.409999999999997 110.688 178.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 12' ' ' THR . 30.7 mmmt -64.42 -34.57 78.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.564 -0.289 . . . . 74.109999999999999 111.024 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.473 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.4 tm? -63.13 -37.27 86.55 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.009 -0.737 . . . . 75.510000000000005 109.009 177.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.47 71.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.657 -0.701 . . . . 74.049999999999997 110.491 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.501 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 12.1 m-80 -59.96 -43.53 95.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.762 -0.654 . . . . 75.219999999999999 110.553 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -65.46 -35.23 80.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.769 -0.651 . . . . 75.200000000000003 111.436 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.37 -27.21 41.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 72.409999999999997 110.633 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.88 -0.91 36.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.316 0.579 . . . . 73.409999999999997 110.288 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 94.4 mt-30 -75.16 -8.85 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.034 -0.53 . . . . 72.319999999999993 109.982 174.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.548 HD21 ' HG2' ' A' ' 26' ' ' GLU . 1.4 m120 -78.93 156.14 28.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.323 -0.853 . . . . 75.540000000000006 110.1 175.168 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.2 t -128.46 -14.78 4.66 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.131 0.491 . . . . 75.450000000000003 109.922 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.548 ' HG2' HD21 ' A' ' 24' ' ' ASN . 1.6 pm0 -83.94 -2.73 57.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.563 -0.744 . . . . 75.230000000000004 110.303 174.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.2 mt -122.86 149.28 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 108.829 -0.804 . . . . 74.200000000000003 108.829 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.716 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -77.8 150.68 34.25 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.813 0.339 . . . . 73.239999999999995 110.391 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -61.3 -31.4 71.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.288 0.566 . . . . 72.109999999999999 109.771 174.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.704 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -68.08 -22.14 74.07 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.495 -0.775 . . . . 65.120000000000005 113.296 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.716 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 11.3 mm-40 -74.24 -34.25 63.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.334 0.588 . . . . 75.310000000000002 109.69 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.5 t -69.43 -44.61 79.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.592 -0.731 . . . . 73.120000000000005 110.534 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.412 ' HB3' ' CE1' ' B' ' 243' ' ' TYR . 15.1 p -65.29 -39.43 92.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.096 -0.502 . . . . 72.209999999999994 110.709 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.95 -35.01 79.79 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.847 -0.615 . . . . 64.329999999999998 110.383 177.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.531 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 52.5 m -63.83 -40.26 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.847 0.356 . . . . 73.409999999999997 110.096 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.708 ' HD1' HD13 ' B' ' 214' ' ' LEU . 10.4 t80 -62.06 -40.53 96.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.362 0.601 . . . . 73.239999999999995 109.737 177.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.65 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.4 ttm -67.14 -45.44 77.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.582 -0.736 . . . . 74.25 111.612 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.599 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 18.8 t-105 -64.61 -35.79 82.16 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.986 0.422 . . . . 72.030000000000001 110.568 177.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.455 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.74 -39.39 93.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.134 -0.485 . . . . 74.219999999999999 110.657 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.548 HD23 ' HE3' ' B' ' 237' ' ' MET . 56.4 tp -65.62 -35.6 81.3 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.466 -0.334 . . . . 73.450000000000003 110.161 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.456 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.3 -44.13 95.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 74.209999999999994 110.809 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.23 -35.68 66.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.175 -0.466 . . . . 73.310000000000002 110.627 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.455 ' HE1' ' HG ' ' B' ' 233' ' ' SER . 9.9 t80 -73.7 -33.51 64.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 64.420000000000002 110.786 -177.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.455 ' HB3' HD12 ' B' ' 277' ' ' LEU . 6.8 t-20 -76.09 -35.71 59.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.083 0.468 . . . . 64.150000000000006 110.767 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.73 -15.1 63.3 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.913 -0.585 . . . . 74.450000000000003 111.311 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -59.29 -35.82 74.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.714 -0.676 . . . . 74.540000000000006 111.428 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.512 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.3 m-85 -71.44 -9.08 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.402 -0.363 . . . . 71.109999999999999 111.888 -176.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.566 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -58.65 -29.56 64.31 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.349 -0.929 . . . . 70.439999999999998 111.294 175.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.2 p -61.44 -32.77 72.75 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.709 0.29 . . . . 73.530000000000001 111.652 -178.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -103.1 16.86 25.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.185 0.517 . . . . 72.340000000000003 110.695 -176.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.29 -47.34 24.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.167 -0.469 . . . . 73.430000000000007 110.72 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.44 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.9 OUTLIER -142.68 -175.11 4.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.32 0.581 . . . . 71.25 112.297 -176.929 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -99.09 -28.06 13.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.916 -1.038 . . . . 65.349999999999994 111.679 -173.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.2 p -127.56 160.01 32.88 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.14 -0.482 . . . . 70.450000000000003 110.302 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.579 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 19.5 ptmt -68.92 -38.01 79.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.548 -0.296 . . . . 75.349999999999994 111.19 -177.132 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -30.2 71.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.502 -0.317 . . . . 74.420000000000002 111.415 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -92.29 -29.12 16.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.031 0.443 . . . . 63.009999999999998 110.557 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.566 ' HE2' ' O ' ' A' ' 48' ' ' GLY . 17.8 ttt -69.73 -43.8 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.724 -0.671 . . . . 75.200000000000003 110.778 178.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.627 ' HB2' HG23 ' B' ' 285' ' ' ILE . 36.1 tt0 -62.62 -33.47 75.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.699 -0.682 . . . . 72.439999999999998 111.639 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.02 -23.75 64.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.095 0.474 . . . . 74.310000000000002 111.133 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.44 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.3 mmmt -89.32 -0.36 57.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.917 -0.583 . . . . 74.5 110.777 -174.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.565 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 10.0 ptpp? -51.75 -47.16 64.2 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 123.597 0.561 . . . . 74.450000000000003 110.491 -175.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.565 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -86.15 -21.92 27.3 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.085 -0.507 . . . . 65.540000000000006 110.214 -175.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -73.41 -40.54 64.19 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.601 -0.727 . . . . 74.200000000000003 110.837 -179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.4 ptp -79.26 -27.58 42.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.257 0.551 . . . . 63.329999999999998 109.584 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.524 ' HE3' ' HB2' ' B' ' 278' ' ' ASP . 90.2 mtp -78.71 -17.33 56.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.813 -0.63 . . . . 75.209999999999994 110.915 177.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -60.63 -31.27 70.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.196 0.522 . . . . 64.439999999999998 111.345 -172.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -108.65 -10.43 15.2 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.598 -0.441 . . . . 72.140000000000001 111.005 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.523 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 5.4 m-30 -58.7 -53.94 52.74 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.623 0.249 . . . . 75.5 111.088 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.801 ' HE3' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -50.97 -53.63 31.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.254 0.55 . . . . 75.239999999999995 110.725 175.825 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.551 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 4.2 t70 -89.5 32.53 0.86 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.394 -0.821 . . . . 74.319999999999993 110.817 -172.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.641 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 2.1 mmm180 -94.01 -37.26 11.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.254 -0.43 . . . . 75.510000000000005 111.221 -177.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.694 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -100.19 10.77 40.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.479 -0.328 . . . . 71.310000000000002 110.464 -178.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 12.8 tttp -59.28 -59.72 5.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.589 . . . . 73.519999999999996 110.578 -176.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -63.35 -29.44 70.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.735 -0.666 . . . . 75.299999999999997 111.561 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.53 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 39.9 mtm -79.49 -27.77 41.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.226 0.536 . . . . 64.230000000000004 109.935 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.757 HD21 ' HD2' ' B' ' 269' ' ' TYR . 65.1 tp -70.11 -43.77 70.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.48 -0.782 . . . . 74.319999999999993 109.676 176.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.552 ' HB2' ' HE2' ' B' ' 266' ' ' MET . 6.2 t70 -59.02 -34.09 71.49 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.278 -0.874 . . . . 72.010000000000005 110.506 175.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.17 -12.49 60.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.41 -0.814 . . . . 71.430000000000007 112.125 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.442 ' OD1' ' HG2' ' B' ' 242' ' ' ARG . 31.4 m-80 -100.92 -20.41 15.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.988 0.423 . . . . 63.149999999999999 111.322 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.456 ' C ' ' H ' ' A' ' 83' ' ' ASP . 63.0 mtt -78.84 -168.07 1.32 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.363 -0.38 . . . . 75.239999999999995 110.019 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 6.4 mm-40 68.46 -32.31 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 113.741 1.015 . . . . 74.400000000000006 113.741 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.456 ' H ' ' C ' ' A' ' 81' ' ' MET . 27.8 t70 -53.25 -58.3 7.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.88 0.326 . . . . 74.329999999999998 111.88 -177.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.559 ' CE1' ' HE1' ' B' ' 258' ' ' MET . 51.0 p90 -88.53 -3.52 58.79 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.875 -0.73 . . . . 74.439999999999998 111.121 179.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.566 HG23 ' HB2' ' B' ' 259' ' ' GLN . 48.6 mt -74.78 -56.91 7.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.082 0.468 . . . . 72.319999999999993 109.84 173.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 10.0 pt-20 -60.86 -38.71 86.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 62.039999999999999 110.672 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -87.93 8.93 23.96 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.293 -0.412 . . . . 61.420000000000002 111.651 -177.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.49 ' O ' ' HB2' ' A' ' 92' ' ' ARG . 72.8 t80 -57.72 -42.32 83.58 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.158 -0.312 . . . . 74.140000000000001 110.158 178.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -57.96 -36.58 72.77 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.156 0.503 . . . . 72.409999999999997 110.019 177.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.536 ' O ' HG21 ' A' ' 94' ' ' THR . 6.3 t60 -69.26 -52.41 27.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.192 -0.913 . . . . 72.230000000000004 110.291 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -64.59 -39.97 94.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.898 0.38 . . . . 74.030000000000001 111.071 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.49 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.1 OUTLIER -66.87 -17.69 65.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.221 0.534 . . . . 74.25 110.264 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -94.36 -24.21 17.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.825 -0.625 . . . . 74.230000000000004 111.141 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.536 HG21 ' O ' ' A' ' 90' ' ' HIS . 81.9 p -72.36 -23.7 61.16 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.003 0.43 . . . . 73.519999999999996 110.872 -179.401 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -90.46 125.3 35.53 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.407 0.622 . . . . 72.530000000000001 110.044 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 115.329 -0.85 . . . . 44.439999999999998 111.259 -175.56 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.832 0.349 . . . . 75.329999999999998 110.482 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -81.01 173.64 12.41 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.734 -0.469 . . . . 71.439999999999998 109.734 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.665 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.1 p-10 -98.54 143.45 28.93 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.653 -0.499 . . . . 75.319999999999993 109.653 178.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . 0.428 ' HB3' ' H ' ' B' ' 205' ' ' ASN . 7.9 tp10 -76.11 -83.43 0.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.11 -0.7 . . . . 74.230000000000004 109.11 177.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . 0.428 ' H ' ' HB3' ' B' ' 204' ' ' GLU . 50.3 t30 -119.57 -30.81 4.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.103 -0.702 . . . . 75.239999999999995 109.103 170.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -88.47 157.18 18.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.688 -0.687 . . . . 73.140000000000001 111.811 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.531 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -86.15 49.57 1.81 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.627 -1.17 . . . . 74.420000000000002 111.954 -175.571 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -45.13 -50.22 11.35 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.438 0.533 . . . . 75.430000000000007 112.438 -176.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . 0.515 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -59.88 -44.09 94.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 75.340000000000003 112.229 -174.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.443 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 32.3 mmt180 -67.28 -49.99 62.1 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.148 0.425 . . . . 74.340000000000003 112.148 -175.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.604 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -63.3 -18.71 63.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.691 0.758 . . . . 72.310000000000002 110.62 -177.458 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 212' ' ' THR . . . . . 0.515 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 49.3 m -68.64 -28.12 66.61 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.006 -0.997 . . . . 75.030000000000001 111.014 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -80.06 -29.32 39.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.462 0.649 . . . . 74.030000000000001 109.509 -179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.708 HD13 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -63.94 -45.43 89.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.214 -0.903 . . . . 75.430000000000007 109.922 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.455 HG13 ' HB1' ' A' ' 39' ' ' ALA . 77.3 mt -66.8 -24.82 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 73.109999999999999 110.302 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -30.57 70.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 74.349999999999994 110.661 -176.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.612 HD13 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -70.37 -40.75 73.81 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.783 -0.821 . . . . 70.109999999999999 108.783 175.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.58 -29.88 70.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.474 -0.784 . . . . 75.450000000000003 110.183 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.506 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 2.7 t-20 -59.9 -38.34 81.99 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.33 -0.85 . . . . 71.239999999999995 110.405 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.41 -39.71 77.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.763 -0.653 . . . . 74.329999999999998 111.282 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -74.0 -25.24 59.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.159 0.504 . . . . 75.540000000000006 110.163 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -84.07 -3.64 58.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.837 -0.62 . . . . 63.399999999999999 110.751 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.506 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 98.5 mt-30 -71.03 -10.73 60.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.436 0.636 . . . . 70.010000000000005 109.94 173.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.497 HD21 ' HG2' ' B' ' 226' ' ' GLU . 0.7 OUTLIER -83.42 128.55 34.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.05 -0.977 . . . . 72.409999999999997 109.723 177.057 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -98.46 -21.82 16.36 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.079 0.466 . . . . 71.510000000000005 110.817 -175.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . 0.497 ' HG2' HD21 ' B' ' 224' ' ' ASN . 1.6 pm0 -76.9 -17.93 58.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.084 0.469 . . . . 70.209999999999994 110.724 176.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 7.3 mt -98.95 153.49 4.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.518 -0.919 . . . . 73.120000000000005 108.518 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.556 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 1.3 mp0 -80.57 146.38 31.28 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.454 -0.572 . . . . 74.200000000000003 109.454 176.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 27.6 m -58.25 -33.12 69.02 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.221 -0.659 . . . . 63.100000000000001 109.221 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.512 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -61.71 -29.71 72.84 Favored Glycine 0 C--N 1.334 0.44 0 CA-C-N 115.084 -0.962 . . . . 24.420000000000002 113.149 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.556 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 11.4 mm-40 -66.2 -36.43 83.05 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 117.356 0.578 . . . . 73.150000000000006 109.657 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.1 t -77.78 -27.75 15.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.371 -0.831 . . . . 73.200000000000003 110.108 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 233' ' ' SER . . . . . 0.455 ' HG ' ' HE1' ' A' ' 43' ' ' TYR . 1.8 m -70.83 -40.92 72.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.797 -0.638 . . . . 65.450000000000003 109.46 176.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -71.44 -34.34 70.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.264 -0.88 . . . . 71.109999999999999 111.223 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.472 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 30.1 p -67.89 -36.41 80.18 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.949 0.404 . . . . 65.420000000000002 110.016 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.572 ' CD1' HD11 ' A' ' 14' ' ' LEU . 6.6 t80 -62.45 -42.04 99.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.522 0.677 . . . . 73.430000000000007 109.421 174.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.694 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 8.6 ttm -66.09 -45.83 79.82 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.518 -0.764 . . . . 74.140000000000001 111.733 179.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.53 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 33.9 t-105 -63.7 -35.45 80.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 72.420000000000002 110.716 177.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -66.17 -35.48 80.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.499 -0.319 . . . . 75.340000000000003 110.789 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.627 HD23 ' HE1' ' A' ' 37' ' ' MET . 52.4 tp -68.04 -35.87 78.97 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.285 -0.635 . . . . 75.239999999999995 109.285 176.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.433 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -66.15 -16.84 64.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.788 -0.642 . . . . 74.319999999999993 111.185 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . 0.442 ' HG2' ' OD1' ' A' ' 80' ' ' ASN . 36.8 mtm180 -95.47 -47.77 6.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.993 0.425 . . . . 75.129999999999995 110.411 176.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.491 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.6 t80 -70.99 -34.57 71.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.827 -0.624 . . . . 70.510000000000005 111.221 -173.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -81.33 -20.28 41.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.056 0.455 . . . . 62.340000000000003 111.229 -175.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -78.8 -7.46 57.87 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.469 . . . . 74.310000000000002 110.746 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -65.45 -27.64 68.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.487 -0.779 . . . . 73.450000000000003 110.908 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.704 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 74.2 m-85 -75.09 -0.52 19.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.08 -0.509 . . . . 72.120000000000005 112.037 -175.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.527 ' HA3' ' HE2' ' B' ' 258' ' ' MET . . . -63.2 -27.59 70.83 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.096 -1.05 . . . . 72.219999999999999 110.694 172.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 75.7 p -70.16 -8.63 51.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.456 -0.372 . . . . 72.340000000000003 111.672 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 10.8 t -120.87 8.29 10.5 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.967 -0.293 . . . . 73.430000000000007 110.873 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 68.6 m -78.0 -44.3 27.03 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-O 120.63 0.252 . . . . 74.25 110.641 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.488 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 2.4 m-85 -149.07 177.57 9.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.867 0.365 . . . . 75.329999999999998 111.231 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -91.5 -34.83 14.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.588 -0.733 . . . . 70.239999999999995 111.897 -172.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 75.4 p -117.98 161.4 19.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.411 -0.359 . . . . 74.439999999999998 110.508 -179.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.426 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.5 ptmt -66.55 -35.05 79.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.488 -0.324 . . . . 71.049999999999997 110.954 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.09 -50.03 73.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.061 0.458 . . . . 74.049999999999997 110.788 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.661 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 22.0 mt-30 -75.51 -23.62 56.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 75.140000000000001 110.392 -177.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.559 ' HE1' ' CE1' ' A' ' 84' ' ' TYR . 13.3 ttt -77.32 -47.52 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 74.150000000000006 110.665 177.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.566 ' HB2' HG23 ' A' ' 85' ' ' ILE . 33.6 tt0 -63.65 -35.07 79.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.693 -0.685 . . . . 63.130000000000003 111.689 -176.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.46 -13.31 62.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.844 0.354 . . . . 73.239999999999995 110.975 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.661 ' HD3' ' O ' ' B' ' 257' ' ' GLN . 3.2 mptp? -106.51 9.95 31.42 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.956 -0.566 . . . . 72.049999999999997 111.134 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.544 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.0 ptpt -50.37 -46.33 55.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 73.420000000000002 110.259 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.544 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.2 tp60 -80.54 -29.74 37.15 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.054 -0.521 . . . . 74.299999999999997 110.057 -177.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -67.26 -39.09 86.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 71.019999999999996 111.413 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -83.72 -24.29 31.27 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.563 -0.532 . . . . 70.049999999999997 109.563 -177.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.552 ' HE2' ' HB2' ' A' ' 78' ' ' ASP . 75.4 mtp -85.03 -22.37 29.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 75.109999999999999 111.599 179.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 17.0 t70 -62.21 -42.64 99.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.992 0.425 . . . . 72.409999999999997 111.025 -170.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.606 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 27.3 p90 -90.35 -14.42 33.12 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.907 -0.588 . . . . 72.019999999999996 110.647 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.757 ' HD2' HD21 ' A' ' 77' ' ' LEU . 1.3 m-30 -57.54 -47.12 82.89 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.606 0.241 . . . . 75.209999999999994 111.052 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.551 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -56.2 -48.13 77.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.195 0.521 . . . . 75.340000000000003 110.422 174.689 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -84.4 20.8 1.58 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.491 -0.777 . . . . 65.340000000000003 111.65 -171.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 14.6 mmm180 -90.38 -51.09 5.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 72.340000000000003 110.813 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.686 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -92.65 8.83 37.43 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.069 -0.514 . . . . 75.019999999999996 110.538 -177.185 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.801 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 87.8 tttt -59.59 -59.48 5.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.919 -0.582 . . . . 73.400000000000006 110.916 -177.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.33 -33.98 77.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.23 -0.441 . . . . 73.040000000000006 111.187 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 276' ' ' MET . . . . . 0.599 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 41.0 mtm -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.108 0.48 . . . . 75.519999999999996 110.441 -178.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.478 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 5.5 tt -70.96 -43.42 68.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.998 -0.742 . . . . 74.040000000000006 108.998 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.524 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 6.1 t70 -56.38 -37.13 69.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.961 -1.018 . . . . 72.209999999999994 111.12 178.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -68.47 -14.98 63.38 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.447 -0.797 . . . . 75.040000000000006 112.36 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -96.6 -13.33 22.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.878 0.371 . . . . 74.439999999999998 111.487 -178.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.432 ' C ' ' H ' ' B' ' 283' ' ' ASP . 62.9 mtt -85.56 179.58 7.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.777 0.323 . . . . 72.120000000000005 111.122 176.504 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.53 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 20.6 mt-10 69.89 -24.06 0.15 Allowed 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.416 1.086 . . . . 71.049999999999997 113.381 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' B' ' 281' ' ' MET . 30.1 t70 -50.25 -60.18 3.23 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.896 0.379 . . . . 73.430000000000007 111.699 -179.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -85.13 5.66 28.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 71.120000000000005 111.221 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.627 HG23 ' HB2' ' A' ' 59' ' ' GLN . 50.3 mt -92.82 -54.73 6.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.876 0.37 . . . . 74.329999999999998 110.507 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.8 pt-20 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.053 -0.521 . . . . 75.409999999999997 110.337 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.38 2.28 52.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 75.430000000000007 111.359 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.579 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 71.0 t80 -55.99 -48.19 76.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.634 0.254 . . . . 74.230000000000004 110.915 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -65.21 -31.33 72.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.712 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -65.55 -57.07 9.08 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.247 -0.649 . . . . 75.439999999999998 109.247 177.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . 0.529 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 21.3 m-85 -61.55 -46.88 88.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.653 -0.703 . . . . 74.140000000000001 111.325 -179.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -55.83 -32.84 63.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.98 0.419 . . . . 75.140000000000001 111.048 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -76.42 -28.65 56.73 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 116.065 -0.516 . . . . 72.049999999999997 111.694 -175.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 24.3 p -97.24 -16.45 20.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.39 -0.368 . . . . 73.400000000000006 111.734 -177.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.529 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 25.7 mt-30 -91.04 143.71 26.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.32 0.581 . . . . 74.540000000000006 111.648 -177.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt . . . . . 0 C--O 1.248 0.986 0 CA-C-N 115.076 -0.965 . . . . 73.129999999999995 109.4 -179.43 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 121.173 0.511 . . . . 73.040000000000006 111.173 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -104.41 -54.64 2.49 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.083 -0.71 . . . . 74.0 109.083 173.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -162.43 135.25 5.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.168 -0.924 . . . . 63.200000000000003 108.944 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.98 -79.69 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.123 0.487 . . . . 64.510000000000005 110.759 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -125.71 -35.85 2.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.947 -0.569 . . . . 74.209999999999994 110.393 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.81 159.82 25.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.091 -0.504 . . . . 74.349999999999994 111.005 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.565 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -82.06 49.17 1.34 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.293 -0.867 . . . . 73.030000000000001 111.995 -176.413 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -51.93 -42.21 62.63 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.046 0.451 . . . . 74.209999999999994 111.235 -178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.11 -13.64 61.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.742 -0.663 . . . . 75.340000000000003 112.509 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 10' ' ' ARG . 20.5 mtm180 -94.71 -57.23 2.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.542 -0.463 . . . . 75.349999999999994 110.262 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.723 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -57.49 -22.47 44.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 64.349999999999994 112.54 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -62.75 -26.92 68.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.745 0.307 . . . . 72.219999999999999 110.955 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.451 ' HB2' HD11 ' B' ' 217' ' ' LEU . 30.0 mt-10 -83.12 -29.56 28.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.169 0.509 . . . . 73.310000000000002 109.772 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.723 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -62.82 -48.58 78.48 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.244 -0.889 . . . . 74.540000000000006 109.42 177.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.483 HG13 ' HB1' ' B' ' 239' ' ' ALA . 78.5 mt -64.07 -33.63 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.661 . . . . 74.129999999999995 110.281 176.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.415 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.6 tmmt? -60.11 -35.13 74.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.608 -0.724 . . . . 75.5 111.48 -176.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.428 HD11 HD13 ' B' ' 214' ' ' LEU . 2.6 tm? -63.54 -45.97 88.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.392 -0.596 . . . . 51.409999999999997 109.392 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.59 68.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.723 -0.671 . . . . 70.120000000000005 111.225 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.45 -26.33 68.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 74.099999999999994 111.214 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.575 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 2.9 mp0 -81.07 -14.97 57.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.838 0.351 . . . . 75.349999999999994 111.057 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -101.44 -35.28 9.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.95 0.405 . . . . 71.299999999999997 110.764 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.636 ' HA ' HG22 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -78.0 -8.95 58.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.208 -0.451 . . . . 73.310000000000002 110.721 -175.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.575 ' NE2' ' HA ' ' A' ' 20' ' ' GLN . 8.7 pt20 -80.87 9.0 7.0 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.839 -0.344 . . . . 74.209999999999994 111.531 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.592 HD21 HG13 ' A' ' 27' ' ' ILE . 1.8 t30 -82.84 103.46 12.34 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.231 -1.026 . . . . 74.510000000000005 108.231 173.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -60.16 -31.68 70.33 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 113.146 0.795 . . . . 74.010000000000005 113.146 -169.249 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -80.68 -13.43 59.03 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.227 0.455 . . . . 75.239999999999995 112.227 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.592 HG13 HD21 ' A' ' 24' ' ' ASN . 9.2 mt -98.66 147.8 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.448 -0.575 . . . . 51.119999999999997 109.448 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -89.42 159.75 17.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.824 0.345 . . . . 73.230000000000004 110.301 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.3 m -56.88 -33.33 66.77 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.529 -0.759 . . . . 75.510000000000005 111.315 -176.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -58.27 -32.4 67.75 Favored Glycine 0 C--N 1.332 0.34 0 CA-C-N 115.62 -0.718 . . . . 54.310000000000002 113.871 -176.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -69.27 -31.79 70.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.27 0.535 . . . . 74.310000000000002 110.932 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.636 HG22 ' HA ' ' A' ' 22' ' ' ASN . 39.3 t -88.63 -40.82 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.855 -0.611 . . . . 74.310000000000002 110.967 -176.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.8 p -61.59 -41.78 97.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.953 0.406 . . . . 72.329999999999998 110.635 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.3 73.88 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.014 -0.539 . . . . 74.329999999999998 110.958 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.474 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 46.2 m -63.51 -36.21 83.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.886 0.374 . . . . 63.43 110.068 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.552 ' CD1' HD11 ' B' ' 214' ' ' LEU . 2.5 t80 -69.5 -32.78 71.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.374 0.606 . . . . 73.439999999999998 109.66 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.776 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.2 tpt -67.36 -52.33 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.45 -0.795 . . . . 73.400000000000006 110.945 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.647 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -63.84 -34.89 78.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.937 -0.574 . . . . 75.450000000000003 110.906 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.41 -40.64 97.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.122 -0.49 . . . . 75.510000000000005 111.095 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.413 HD23 ' HE3' ' B' ' 237' ' ' MET . 53.9 tp -68.37 -35.29 77.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.734 -0.469 . . . . 64.25 109.734 178.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.88 77.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.400000000000006 111.0 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.439 ' HG2' ' CG ' ' B' ' 280' ' ' ASN . 10.8 mtp180 -77.48 -46.46 22.42 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.019 -0.272 . . . . 74.239999999999995 111.139 177.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.566 ' HD2' HG22 ' B' ' 215' ' ' ILE . 7.5 t80 -66.57 -31.86 72.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 62.409999999999997 110.884 -175.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -77.33 -38.3 50.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.038 0.447 . . . . 62.409999999999997 109.95 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.88 -19.61 65.04 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.792 -0.64 . . . . 71.230000000000004 111.171 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.5 t90 -59.39 -33.54 71.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.845 -0.616 . . . . 74.409999999999997 110.029 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -82.66 -5.47 58.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 75.129999999999995 111.131 178.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.545 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -70.62 -23.87 77.36 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.896 -0.881 . . . . 73.349999999999994 110.896 174.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -61.46 -31.84 71.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.949 0.405 . . . . 71.109999999999999 111.26 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -97.91 13.42 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 74.439999999999998 111.103 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.1 m -77.02 -34.59 57.38 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 111.854 0.316 . . . . 71.340000000000003 111.854 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.704 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -143.33 -172.27 3.66 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.641 -0.424 . . . . 75.150000000000006 111.63 -179.551 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.704 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 16.9 pt-20 -108.31 -30.11 8.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.376 -0.829 . . . . 72.099999999999994 112.025 -170.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.443 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 47.1 p -127.87 155.28 44.4 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 109.715 -0.476 . . . . 70.329999999999998 109.715 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -72.03 -29.57 64.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.84 -0.344 . . . . 74.25 110.77 -177.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.443 ' OE1' ' HB ' ' A' ' 54' ' ' THR . 2.0 mp0 -60.92 -46.19 91.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.231 0.538 . . . . 74.140000000000001 110.186 177.487 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.678 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 24.6 mt-30 -81.58 -37.57 27.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.667 -0.697 . . . . 74.230000000000004 110.581 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.545 ' HE2' ' O ' ' A' ' 48' ' ' GLY . 16.5 ttt -63.17 -42.73 99.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 71.219999999999999 111.211 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 34.9 tt0 -64.69 -32.18 73.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.277 -0.419 . . . . 72.239999999999995 110.583 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.57 -12.34 60.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.149 0.5 . . . . 75.519999999999996 110.854 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.678 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -106.53 11.1 31.0 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.208 -0.451 . . . . 74.030000000000001 109.979 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.611 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 15.4 ptpt -54.27 -49.37 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 71.540000000000006 110.064 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.611 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.4 tp60 -75.15 -26.97 59.55 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.98 -0.555 . . . . 74.439999999999998 110.239 -176.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.532 ' HG2' ' HA ' ' A' ' 61' ' ' LYS . 25.0 mm-40 -58.85 -49.47 77.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.99 -0.55 . . . . 74.230000000000004 111.011 -178.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.4 ptt? -82.69 -34.86 27.2 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.067 0.46 . . . . 74.510000000000005 110.631 -177.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.659 ' HE2' ' HB3' ' B' ' 277' ' ' LEU . 67.1 mtp -77.08 -21.98 53.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 74.299999999999997 112.097 -174.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.446 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 25.6 t70 -58.95 -36.25 74.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 73.230000000000004 111.365 -171.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.477 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 28.2 p90 -107.15 -6.11 17.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 72.510000000000005 111.534 -176.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.518 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 3.4 m-30 -58.56 -41.95 86.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.709 0.29 . . . . 73.349999999999994 110.943 -178.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.49 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -53.28 -52.35 59.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 71.510000000000005 110.665 174.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -90.48 65.98 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 75.200000000000003 110.958 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 15.3 mmm-85 -130.98 -23.24 2.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.195 -0.457 . . . . 71.140000000000001 111.337 177.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.746 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -116.05 7.74 14.35 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.543 -0.463 . . . . 74.519999999999996 111.755 -178.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.422 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 6.3 pttm -76.2 -33.92 59.29 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.856 -0.738 . . . . 74.120000000000005 110.323 -173.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 1.6 pm0 -67.69 -25.17 65.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.278 0.561 . . . . 74.109999999999999 110.604 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.495 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 58.5 mtm -91.16 -18.95 23.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.818 -0.628 . . . . 71.219999999999999 109.971 178.116 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.484 HD11 ' HB3' ' B' ' 244' ' ' ASN . 7.0 tt -82.39 -37.39 25.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.73 -0.668 . . . . 74.140000000000001 109.729 176.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.487 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 12.8 t70 -57.81 -37.56 73.99 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.256 0.551 . . . . 70.040000000000006 110.142 177.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.1 70.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.265 -0.879 . . . . 73.129999999999995 111.679 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -82.83 -23.09 33.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.016 0.436 . . . . 75.010000000000005 110.286 -178.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.48 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.3 mmt -66.54 -50.28 63.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.81 -0.632 . . . . 72.340000000000003 110.123 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.491 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 44.7 mt-10 -55.77 -31.82 62.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.681 -0.69 . . . . 73.299999999999997 111.637 -177.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -53.7 -34.74 59.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.855 0.36 . . . . 74.439999999999998 111.04 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.72 -29.14 10.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.286 -0.415 . . . . 74.510000000000005 111.255 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 81' ' ' MET . 58.5 mt -66.77 -64.53 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.653 0.242 . . . . 65.239999999999995 111.653 -178.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.3 pt-20 -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.451 -0.5 . . . . 75.0 110.745 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -93.04 15.72 14.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.139 -0.482 . . . . 73.450000000000003 111.004 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.569 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 24.7 t80 -54.46 -49.78 69.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.707 0.289 . . . . 74.010000000000005 110.985 178.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -61.91 -23.24 66.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 111.004 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -78.97 -50.9 10.38 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.804 -0.443 . . . . 72.530000000000001 109.804 177.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.506 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 73.3 m-85 -62.98 -42.63 99.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 74.120000000000005 111.018 178.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -69.77 -4.31 19.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.297 0.57 . . . . 74.230000000000004 110.817 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -97.3 -29.57 13.47 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.142 -0.481 . . . . 73.25 110.43 177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 p -89.95 -35.23 15.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.04 -0.527 . . . . 72.409999999999997 110.331 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.506 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -117.26 141.64 48.04 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.287 -0.635 . . . . 75.400000000000006 109.287 176.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.413 ' HE3' ' HB2' ' A' ' 96' ' ' LYS . 44.4 mtmt . . . . . 0 C--N 1.321 -0.666 0 CA-C-N 116.183 -0.462 . . . . 73.349999999999994 110.611 -176.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 71.0 m . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.123 0.487 . . . . 70.450000000000003 111.105 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -131.27 -172.59 2.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.738 -0.664 . . . . 65.25 109.692 177.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 -101.18 156.39 17.46 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.665 0.269 . . . . 75.120000000000005 110.562 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -82.76 -94.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 75.450000000000003 111.164 -177.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -103.32 -26.66 12.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.879 -0.6 . . . . 61.409999999999997 110.055 -177.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.561 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -110.0 153.29 24.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.581 -0.736 . . . . 64.439999999999998 110.475 176.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.647 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -79.05 54.89 1.69 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.422 -0.808 . . . . 71.510000000000005 112.464 -177.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.422 ' CE1' ' HB3' ' B' ' 206' ' ' ALA . 17.6 m-85 -50.95 -40.8 58.4 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.92 0.39 . . . . 75.219999999999999 111.379 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.34 -27.53 66.0 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.479 -0.782 . . . . 71.519999999999996 112.696 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 53.6 mtm-85 -91.88 -55.38 3.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.548 -0.461 . . . . 73.349999999999994 110.651 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.589 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -57.4 -22.64 44.31 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 73.25 112.814 -177.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 7.0 t -67.04 -25.81 66.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.95 0.405 . . . . 64.140000000000001 110.51 -177.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -82.45 -29.22 30.79 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.345 0.593 . . . . 73.439999999999998 109.787 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.589 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -64.51 -45.35 87.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.076 -0.965 . . . . 74.530000000000001 109.392 177.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.566 HG22 ' HD2' ' A' ' 43' ' ' TYR . 82.0 mt -67.35 -33.03 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.564 -0.744 . . . . 73.530000000000001 110.452 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -35.59 73.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.683 -0.69 . . . . 73.129999999999995 111.286 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.523 HD13 HD12 ' A' ' 14' ' ' LEU . 3.1 tm? -64.57 -45.37 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.414 -0.587 . . . . 75.329999999999998 109.414 178.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.88 -31.84 68.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 74.349999999999994 111.164 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.483 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -61.08 -38.08 84.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 73.239999999999995 110.919 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -67.68 -34.48 76.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.197 -0.456 . . . . 71.349999999999994 111.466 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -79.33 -23.07 43.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.445 0.64 . . . . 73.510000000000005 110.049 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -75.64 -16.25 60.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.266 -0.879 . . . . 74.209999999999994 110.267 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 35.7 mt-30 -76.63 -4.11 41.29 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 74.409999999999997 111.201 -179.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.538 HD21 HG13 ' B' ' 227' ' ' ILE . 1.5 t30 -73.01 107.66 5.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.545 -0.539 . . . . 52.130000000000003 109.545 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.0 t -57.71 -35.71 71.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.017 0.747 . . . . 75.209999999999994 113.017 -171.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -85.32 1.55 47.93 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.508 0.559 . . . . 73.319999999999993 112.508 -177.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.538 HG13 HD21 ' B' ' 224' ' ' ASN . 5.1 mt -113.76 149.85 16.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.03 0.443 . . . . 61.310000000000002 110.326 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -92.53 160.22 15.14 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.853 -0.612 . . . . 65.519999999999996 109.875 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 6.8 m -63.02 -29.63 70.97 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.19 -0.459 . . . . 75.530000000000001 111.227 -176.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -67.38 -12.22 60.71 Favored Glycine 0 C--N 1.331 0.297 0 CA-C-N 115.901 -0.59 . . . . 73.420000000000002 113.339 -177.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.404 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 67.9 mm-40 -83.47 -25.79 30.84 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.342 -0.505 . . . . 74.409999999999997 110.524 178.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.9 t -85.35 -39.16 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.963 -0.562 . . . . 73.340000000000003 110.43 -177.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.2 p -59.06 -41.64 88.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 74.299999999999997 110.957 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.83 -32.1 71.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 74.439999999999998 111.016 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 49.9 m -65.43 -38.02 88.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.82 0.343 . . . . 62.399999999999999 110.279 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.662 ' HD1' HD13 ' A' ' 14' ' ' LEU . 11.9 t80 -66.36 -33.66 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.259 0.552 . . . . 65.329999999999998 109.831 178.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.746 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 9.3 ttm -69.18 -46.0 68.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.507 -0.769 . . . . 74.540000000000006 111.735 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.565 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 19.8 t-105 -64.59 -38.51 91.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.85 0.357 . . . . 74.010000000000005 110.645 177.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.493 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -61.82 -40.29 94.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.051 -0.522 . . . . 71.129999999999995 110.667 178.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.776 HD21 ' SD ' ' A' ' 37' ' ' MET . 45.3 tp -67.84 -32.6 73.24 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.257 -0.429 . . . . 72.010000000000005 110.831 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.42 -37.35 85.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.010000000000005 110.893 178.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -80.77 -30.69 36.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 75.299999999999997 110.888 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.48 ' HD2' HG23 ' A' ' 15' ' ' ILE . 6.6 t80 -82.07 -33.07 30.03 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.082 -0.508 . . . . 72.219999999999999 110.999 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . 0.484 ' HB3' HD11 ' A' ' 77' ' ' LEU . 9.9 t-20 -78.28 -38.71 41.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.416 -0.356 . . . . 72.420000000000002 111.177 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -63.8 -13.38 43.79 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.073 0.463 . . . . 73.420000000000002 111.482 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -54.02 -36.37 62.93 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.511 -0.768 . . . . 71.140000000000001 110.258 175.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -78.36 -5.55 52.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 74.099999999999994 111.958 -177.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.507 ' O ' ' HE1' ' B' ' 258' ' ' MET . . . -65.67 -29.82 75.97 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.402 -0.904 . . . . 64.409999999999997 111.578 176.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.5 p -65.07 -34.95 79.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.995 0.426 . . . . 74.209999999999994 111.298 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.2 t -92.35 7.74 41.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.419 -0.355 . . . . 71.310000000000002 111.298 -176.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 71.2 m -74.41 -40.16 62.18 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 116.737 -0.211 . . . . 63.009999999999998 111.386 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.528 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -151.41 -179.31 7.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.19 0.519 . . . . 74.010000000000005 111.731 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -94.42 -45.43 7.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.216 -0.902 . . . . 74.239999999999995 111.704 -173.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 41.2 p -106.1 157.87 17.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.369 -0.378 . . . . 70.129999999999995 110.227 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.569 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 11.2 ptmm? -66.84 -33.28 75.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.88 0.372 . . . . 74.439999999999998 110.237 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.11 -50.39 73.42 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.61 -0.723 . . . . 74.230000000000004 110.738 -179.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.572 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 24.2 mt-30 -78.66 -31.88 46.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.981 -0.554 . . . . 62.329999999999998 110.845 -177.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.507 ' HE1' ' O ' ' B' ' 248' ' ' GLY . 13.7 ttt -64.96 -43.77 91.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.133 0.492 . . . . 75.530000000000001 110.194 176.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -63.09 -35.32 79.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.532 -0.758 . . . . 75.319999999999993 110.859 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.3 -11.5 60.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.222 -0.445 . . . . 60.149999999999999 111.197 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -113.44 -1.19 14.24 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.499 -0.319 . . . . 73.430000000000007 110.51 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.685 ' HA ' ' HE1' ' B' ' 265' ' ' MET . 29.1 ttpp -55.4 -54.79 39.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.486 -0.324 . . . . 65.129999999999995 111.206 -176.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -68.41 -26.72 65.68 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.973 -0.291 . . . . 73.530000000000001 110.74 -178.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -73.54 -37.88 65.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.524 -0.307 . . . . 72.420000000000002 111.285 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.685 ' HE1' ' HA ' ' B' ' 262' ' ' LYS . 17.9 ptp -79.85 -30.21 40.26 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.297 -1.001 . . . . 74.409999999999997 108.297 177.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.487 ' HE3' ' HB2' ' A' ' 78' ' ' ASP . 58.5 mtp -90.5 29.77 1.24 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.981 -1.008 . . . . 74.120000000000005 110.638 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -111.03 -32.91 6.64 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.958 -1.126 . . . . 75.140000000000001 107.958 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -87.16 -33.72 19.3 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.576 -1.193 . . . . 74.329999999999998 112.617 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -52.53 -52.52 54.39 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.987 -0.745 . . . . 74.450000000000003 108.987 177.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.49 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -65.45 -60.72 2.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.225 0.536 . . . . 71.329999999999998 110.829 174.263 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -88.82 62.96 6.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.811 -0.631 . . . . 72.329999999999998 112.04 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -147.76 -29.07 0.33 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 72.420000000000002 111.695 171.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.555 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -84.41 0.9 47.71 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.801 -0.814 . . . . 75.349999999999994 108.801 174.886 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.486 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 86.9 tttt -64.32 -53.87 42.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.414 -1.266 . . . . 74.25 110.676 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.25 -30.84 69.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.43 . . . . 73.510000000000005 111.818 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 276' ' ' MET . . . . . 0.486 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 60.1 mtm -84.87 -26.66 27.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.84 0.352 . . . . 74.409999999999997 110.602 -179.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.659 ' HB3' ' HE2' ' A' ' 66' ' ' MET . 3.7 tt -67.02 -33.92 76.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.016 -0.538 . . . . 74.450000000000003 109.784 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -61.29 -44.18 97.65 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.837 -0.62 . . . . 72.140000000000001 110.831 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.34 65.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.391 -0.822 . . . . 65.230000000000004 111.159 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . 0.439 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 86.1 m-20 -88.65 -15.91 33.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.046 -0.525 . . . . 74.019999999999996 110.344 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.412 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -75.5 -39.47 58.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 72.340000000000003 109.844 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.653 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 42.7 mt-10 -51.22 -39.59 56.9 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.374 -0.83 . . . . 73.400000000000006 111.934 -176.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -44.7 -47.81 10.66 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.939 0.774 . . . . 74.319999999999993 111.855 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -90.41 -29.86 17.75 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.249 -0.432 . . . . 73.239999999999995 111.017 -177.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.412 HG13 ' O ' ' B' ' 281' ' ' MET . 72.4 mt -64.37 -55.53 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 73.340000000000003 110.992 179.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.653 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -68.75 -17.63 64.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.283 -0.417 . . . . 72.239999999999995 111.664 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -107.95 9.46 28.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.921 0.341 . . . . 73.019999999999996 111.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -55.68 -45.73 77.73 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.792 0.329 . . . . 74.230000000000004 110.572 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -57.46 -33.52 68.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.848 -0.615 . . . . 71.409999999999997 110.978 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -77.43 -50.33 12.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.242 -0.435 . . . . 72.049999999999997 110.643 -177.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . 0.553 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 58.3 m-85 -60.57 -52.03 66.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.358 -0.383 . . . . 75.219999999999999 111.359 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.567 ' NH1' ' HA ' ' B' ' 296' ' ' LYS . 13.2 tpp180 -66.83 -13.42 61.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.093 0.473 . . . . 74.430000000000007 111.07 -177.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -83.86 -31.97 25.47 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.227 0.537 . . . . 51.229999999999997 110.532 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 4.1 p -95.47 -39.3 10.05 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.549 -0.751 . . . . 73.420000000000002 111.298 -176.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.553 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 0.0 OUTLIER -123.72 161.56 24.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.536 0.684 . . . . 64.120000000000005 112.056 -176.348 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . 0.567 ' HA ' ' NH1' ' B' ' 292' ' ' ARG . 44.0 mtmt . . . . . 0 C--O 1.246 0.918 0 CA-C-N 114.919 -1.037 . . . . 74.120000000000005 109.542 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.844 0.354 . . . . 72.349999999999994 110.826 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -71.89 148.58 45.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.33 -0.395 . . . . 73.200000000000003 111.067 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.585 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 1.7 p-10 -146.34 132.43 19.31 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.003 -0.544 . . . . 75.239999999999995 109.665 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.91 -89.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 63.539999999999999 110.642 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -111.3 -22.34 11.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.833 -0.621 . . . . 72.439999999999998 110.183 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.69 160.96 17.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 75.329999999999998 111.192 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.462 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -85.41 49.98 1.86 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.236 -0.893 . . . . 65.120000000000005 111.769 -177.668 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.585 ' HD2' ' HB2' ' A' ' 3' ' ' ASN . 89.5 m-85 -52.19 -46.3 65.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.037 0.446 . . . . 74.349999999999994 111.321 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.53 -6.53 47.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 60.310000000000002 112.02 -174.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.552 ' HA ' ' NE ' ' A' ' 10' ' ' ARG . 4.1 mmp_? -96.37 -58.45 2.06 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 121.089 -0.244 . . . . 71.310000000000002 110.561 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.678 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -56.42 -20.35 19.29 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.626 0.602 . . . . 73.099999999999994 112.626 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.3 t -69.35 -23.34 63.75 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 121.03 -0.268 . . . . 71.439999999999998 111.334 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.52 ' HB2' HD11 ' B' ' 217' ' ' LEU . 59.9 mt-10 -80.66 -28.63 36.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.271 -0.641 . . . . 73.340000000000003 109.271 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.678 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -64.41 -43.19 95.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.246 -0.888 . . . . 75.340000000000003 109.6 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 78.2 mt -69.46 -25.17 28.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.547 -0.751 . . . . 74.030000000000001 110.55 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.492 ' HD2' ' HA ' ' A' ' 16' ' ' LYS . 22.2 mmmt -61.75 -38.51 88.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.374 -0.375 . . . . 75.120000000000005 111.872 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.493 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.1 tm? -65.4 -34.23 77.81 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.235 -0.654 . . . . 75.519999999999996 109.235 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.98 -35.94 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.584 -0.735 . . . . 74.329999999999998 110.393 -177.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -69.92 -12.3 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.969 -0.56 . . . . 75.129999999999995 111.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.29 -39.65 17.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.792 0.329 . . . . 74.25 110.692 175.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -76.35 -22.48 54.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.293 0.568 . . . . 64.109999999999999 110.259 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.409 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 4.3 t-20 -73.23 -11.82 60.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 74.230000000000004 110.553 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -82.22 0.83 39.39 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 116.096 -0.502 . . . . 73.5 111.674 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.615 HD21 HG13 ' A' ' 27' ' ' ILE . 2.9 t30 -73.77 115.46 13.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.22 -0.659 . . . . 73.310000000000002 109.22 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -50.18 -41.6 49.65 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.794 1.035 . . . . 74.450000000000003 113.794 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -97.5 2.44 50.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.111 0.782 . . . . 73.340000000000003 113.111 -171.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.615 HG13 HD21 ' A' ' 24' ' ' ASN . 7.7 mt -104.66 157.54 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.568 -0.53 . . . . 73.450000000000003 109.568 178.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -96.45 167.61 11.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.555 -0.535 . . . . 74.209999999999994 109.555 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.409 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 5.7 m -60.52 -32.12 71.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.016 0.436 . . . . 73.310000000000002 109.871 174.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.683 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -59.46 -38.21 93.19 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.258 -0.883 . . . . 63.409999999999997 113.714 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -64.91 -36.79 85.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.163 0.506 . . . . 72.129999999999995 110.439 -176.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 17.8 t -73.74 -39.14 52.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.866 -0.607 . . . . 72.150000000000006 110.199 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m -59.56 -41.85 91.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.236 0.541 . . . . 71.019999999999996 110.248 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.418 ' O ' ' HB3' ' A' ' 37' ' ' MET . . . -69.4 -29.92 67.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.641 -0.709 . . . . 71.530000000000001 110.938 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.2 m -65.18 -38.08 89.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.021 0.439 . . . . 73.409999999999997 109.911 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.829 ' HB3' HD11 ' B' ' 240' ' ' LEU . 1.6 t80 -67.99 -34.37 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.849 -0.614 . . . . 74.530000000000001 109.753 177.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.767 ' HE3' HD23 ' B' ' 240' ' ' LEU . 0.8 OUTLIER -61.71 -53.49 55.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.364 -0.834 . . . . 74.0 110.762 177.156 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.46 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 24.2 t-105 -64.89 -40.24 94.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 74.230000000000004 111.012 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.38 93.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.343 -0.39 . . . . 72.450000000000003 111.241 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 48.3 tp -61.98 -38.18 87.6 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.593 -0.276 . . . . 75.299999999999997 110.285 178.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.463 ' HA ' HD11 ' B' ' 277' ' ' LEU . . . -61.82 -46.07 91.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 70.519999999999996 110.711 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -66.86 -39.75 87.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.191 -0.459 . . . . 73.439999999999998 111.059 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.713 ' HD2' HG23 ' B' ' 215' ' ' ILE . 11.0 t80 -76.94 -33.93 57.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.372 -0.377 . . . . 74.230000000000004 110.853 -176.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 9.8 t-20 -73.02 -43.3 62.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.217 -0.447 . . . . 75.140000000000001 110.759 -176.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.461 ' HB1' HD12 ' B' ' 277' ' ' LEU . . . -67.67 -18.61 65.0 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.175 -0.466 . . . . 71.530000000000001 111.335 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -59.01 -30.62 68.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.978 -0.555 . . . . 75.129999999999995 110.496 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -83.91 -10.11 58.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 73.109999999999999 111.282 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.535 ' O ' ' HE2' ' A' ' 58' ' ' MET . . . -66.77 -24.02 72.64 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.466 -0.873 . . . . 75.099999999999994 111.383 176.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 79.3 p -69.92 -15.15 63.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 63.109999999999999 111.355 -178.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.9 t -114.47 13.26 17.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 72.230000000000004 110.855 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -72.04 -35.09 69.25 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 116.505 -0.316 . . . . 53.310000000000002 111.501 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.635 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.2 m-85 -147.92 178.74 8.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.409 0.623 . . . . 63.020000000000003 112.387 -178.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.579 ' HG3' HG22 ' A' ' 54' ' ' THR . 15.1 pt-20 -91.7 -34.58 14.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.766 -1.107 . . . . 72.349999999999994 110.798 -171.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.607 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 80.5 p -124.71 159.3 31.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.498 -0.774 . . . . 74.409999999999997 109.219 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.639 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 6.6 pttm -78.67 -23.6 45.61 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.424 -0.51 . . . . 71.519999999999996 110.557 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.607 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.6 mp0 -61.34 -40.73 95.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.256 0.55 . . . . 74.450000000000003 109.808 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.753 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 21.1 mt-30 -83.52 -40.83 18.67 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.514 -0.766 . . . . 65.120000000000005 109.684 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.639 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 17.1 ttt -57.21 -44.55 83.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.755 -0.657 . . . . 73.010000000000005 111.605 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.594 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.3 tt0 -59.95 -39.34 85.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.343 -0.389 . . . . 72.129999999999995 111.052 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.68 -0.09 19.51 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.998 -0.547 . . . . 73.140000000000001 111.24 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.753 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.7 mmmt -112.47 -6.62 13.97 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.55 -0.295 . . . . 72.219999999999999 111.24 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.731 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 34.2 pttt -63.87 -43.34 96.38 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 119.996 -0.682 . . . . 72.019999999999996 110.146 -176.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.566 ' O ' ' HB2' ' A' ' 67' ' ' ASP . 21.5 mm-40 -83.16 3.19 31.89 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.033 0.444 . . . . 73.239999999999995 111.168 177.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.41 ' CD ' ' HZ1' ' A' ' 61' ' ' LYS . 34.6 mt-10 -97.47 -32.83 11.63 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.651 -0.704 . . . . 73.310000000000002 110.426 171.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.731 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 16.7 ptp -85.15 -35.26 21.84 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.682 -0.859 . . . . 73.430000000000007 108.682 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.582 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 69.0 mtp -80.64 -18.83 46.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.727 -0.669 . . . . 74.349999999999994 111.091 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.566 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 22.7 t70 -47.74 -45.75 29.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.672 0.608 . . . . 75.340000000000003 111.038 -178.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -108.15 -4.92 17.23 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.399 -0.819 . . . . 73.430000000000007 111.115 -176.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.623 ' HD2' HD22 ' B' ' 277' ' ' LEU . 1.8 m-30 -59.22 -48.26 82.28 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 121.305 -0.158 . . . . 73.409999999999997 111.05 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.543 ' HE3' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.08 -51.58 63.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.166 0.507 . . . . 54.43 110.206 175.892 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.452 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 1.9 t70 -90.7 22.74 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.65 -0.704 . . . . 74.239999999999995 111.291 -171.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.571 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 3.2 mmm180 -84.71 -44.93 12.92 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.209 0.528 . . . . 74.120000000000005 110.251 -176.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.715 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -95.44 15.09 20.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.663 -0.699 . . . . 72.530000000000001 109.929 -179.107 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.452 ' HD2' ' OD2' ' A' ' 71' ' ' ASP . 20.0 tttp -56.15 -61.87 2.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.377 -0.829 . . . . 74.150000000000006 110.345 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -67.38 -31.12 71.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.669 -0.696 . . . . 73.219999999999999 110.977 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.8 mtt -62.04 -38.86 90.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.349 0.595 . . . . 74.140000000000001 109.816 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.709 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.6 tt -73.55 -42.28 61.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.298 -0.865 . . . . 74.209999999999994 109.499 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.474 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 4.9 t70 -57.67 -42.04 82.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.447 -0.797 . . . . 73.230000000000004 110.831 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.59 -16.05 59.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.416 -0.811 . . . . 61.039999999999999 112.233 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -105.06 -16.07 14.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.844 0.354 . . . . 73.439999999999998 110.492 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.532 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 14.0 mmt -67.6 -63.02 1.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.906 -0.588 . . . . 74.5 111.55 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.622 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 8.3 pt-20 -80.6 1.85 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.835 0.68 . . . . 72.409999999999997 112.835 -170.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.39 -49.67 76.91 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.152 -0.684 . . . . 70.129999999999995 109.152 171.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -72.86 -38.26 67.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.482 -0.781 . . . . 72.430000000000007 110.189 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.718 HG21 ' HB2' ' B' ' 259' ' ' GLN . 66.7 mt -58.97 -54.25 36.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.523 -0.762 . . . . 74.450000000000003 111.941 -176.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.622 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.1 pt-20 -66.48 -12.15 55.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.652 0.263 . . . . 72.519999999999996 111.673 -177.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -110.57 11.4 22.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.668 -0.242 . . . . 74.310000000000002 111.4 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.467 ' CE2' ' HA ' ' B' ' 254' ' ' THR . 8.5 t80 -52.71 -56.37 16.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.282 . . . . 74.340000000000003 110.294 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.29 -30.3 71.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.913 -0.585 . . . . 74.040000000000006 110.911 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -63.03 -58.93 5.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.101 -0.499 . . . . 73.219999999999999 110.133 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.401 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 42.5 m-85 -65.63 -45.62 82.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.426 -0.352 . . . . 75.030000000000001 110.91 -178.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.481 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 2.4 tmm_? -60.6 -23.96 65.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.551 . . . . 74.219999999999999 110.44 -177.196 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.59 -39.78 62.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.149 -0.478 . . . . 61.43 110.654 -179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 35.7 p -79.61 -23.4 42.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.816 -0.629 . . . . 73.340000000000003 111.277 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 27.2 mt-30 -81.95 111.74 18.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.355 0.597 . . . . 71.049999999999997 110.951 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt . . . . . 0 C--N 1.317 -0.845 0 CA-C-N 115.306 -0.861 . . . . 74.049999999999997 110.365 -176.933 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 0 C--O 1.234 0.256 0 CA-C-O 121.125 0.488 . . . . 74.109999999999999 110.46 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -142.06 164.23 30.72 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.029 -0.73 . . . . 63.32 109.029 178.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.8 p-10 -142.95 139.31 30.63 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 121.004 -0.278 . . . . 75.109999999999999 110.598 -178.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -68.92 -77.69 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.016 0.436 . . . . 75.5 110.162 175.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -128.51 -31.15 2.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 74.230000000000004 110.323 176.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -86.68 179.35 6.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.733 -0.667 . . . . 54.299999999999997 111.339 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.522 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -79.68 43.93 0.6 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.433 -0.803 . . . . 75.420000000000002 112.674 -174.264 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.75 -43.39 85.37 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.667 0.247 . . . . 72.310000000000002 111.667 -177.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.96 -14.88 62.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.033 0.444 . . . . 71.310000000000002 111.447 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.522 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 1.4 mmp_? -91.0 -62.16 1.51 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.343 -0.39 . . . . 74.340000000000003 110.17 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.793 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -55.37 -25.77 37.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.699 0.629 . . . . 55.229999999999997 112.699 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 212' ' ' THR . . . . . 0.453 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -67.97 -21.16 65.09 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.764 0.316 . . . . 73.5 110.946 -178.691 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -84.64 -27.58 27.06 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.619 -0.511 . . . . 74.319999999999993 109.619 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.793 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -62.44 -41.32 98.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.514 -0.767 . . . . 75.239999999999995 109.43 176.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.713 HG23 ' HD2' ' A' ' 43' ' ' TYR . 87.5 mt -68.8 -22.83 26.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.204 -0.907 . . . . 73.239999999999995 111.027 178.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' B' ' 212' ' ' THR . 30.6 mmmt -66.58 -40.42 88.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 73.340000000000003 111.603 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.52 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -62.47 -35.98 81.04 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.058 -0.719 . . . . 75.430000000000007 109.058 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . 0.413 ' O ' HG13 ' B' ' 232' ' ' VAL . . . -67.84 -37.42 81.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.731 -0.668 . . . . 71.530000000000001 110.145 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 29.2 m-80 -74.37 -6.49 48.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.99 -0.55 . . . . 72.099999999999994 111.509 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -93.98 -32.81 13.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.368 . . . . 74.219999999999999 110.789 175.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -75.78 -27.09 57.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.508 0.671 . . . . 74.120000000000005 109.689 175.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . 0.402 HD22 HG22 ' B' ' 229' ' ' THR . 3.5 t-20 -71.72 -12.76 61.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.985 -1.007 . . . . 74.409999999999997 110.481 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 86.9 mm-40 -75.22 -15.04 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.102 -0.499 . . . . 73.430000000000007 111.578 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.728 HD21 HG13 ' B' ' 227' ' ' ILE . 7.1 t30 -71.56 122.45 20.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.189 0.519 . . . . 54.25 109.719 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -65.66 -30.28 70.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.241 -0.89 . . . . 74.25 112.162 -174.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.14 -1.33 45.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.443 0.534 . . . . 71.329999999999998 112.443 -172.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.728 HG13 HD21 ' B' ' 224' ' ' ASN . 8.9 mt -99.2 148.63 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.358 -0.608 . . . . 75.329999999999998 109.358 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.792 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 42.7 mt-30 -78.21 147.38 34.47 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.859 -0.609 . . . . 75.230000000000004 109.865 178.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 229' ' ' THR . . . . . 0.402 HG22 HD22 ' B' ' 222' ' ' ASN . 3.8 m -59.82 -34.63 73.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.041 0.448 . . . . 73.319999999999993 110.662 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.28 87.68 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.861 -0.609 . . . . 75.25 113.816 -176.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.792 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 16.8 mm-40 -80.49 -29.52 37.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.842 0.821 . . . . 74.219999999999999 109.674 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . 0.413 HG13 ' O ' ' B' ' 218' ' ' ALA . 27.7 t -77.35 -41.34 29.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.27 -0.877 . . . . 75.230000000000004 110.938 -176.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.8 p -62.27 -40.16 95.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 72.109999999999999 110.816 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.45 75.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.899 -0.591 . . . . 74.310000000000002 110.934 179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 64.0 m -65.06 -34.24 77.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 71.239999999999995 110.715 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.543 ' CD1' HD12 ' A' ' 14' ' ' LEU . 5.3 t80 -65.83 -36.65 84.07 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.309 0.576 . . . . 72.239999999999995 109.808 178.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.715 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.6 ttm -69.52 -48.39 60.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.751 -0.658 . . . . 64.030000000000001 111.547 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.462 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 34.9 t-105 -63.33 -35.04 79.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.327 . . . . 72.519999999999996 110.782 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.489 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -64.95 -40.49 95.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 75.120000000000005 110.894 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.829 HD11 ' HB3' ' A' ' 36' ' ' PHE . 43.8 tp -69.1 -32.13 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.979 0.418 . . . . 74.340000000000003 110.399 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.432 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -63.06 -41.4 99.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.901 -0.591 . . . . 63.140000000000001 110.829 178.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -75.3 -26.65 58.88 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.15 0.5 . . . . 74.319999999999993 110.275 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -81.4 -36.52 29.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.716 -0.674 . . . . 74.439999999999998 110.854 -176.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -74.76 -27.82 60.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.659 0.266 . . . . 72.319999999999993 111.376 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . 0.532 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -71.98 -16.0 62.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.243 0.544 . . . . 65.129999999999995 111.105 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -55.88 -33.68 64.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 73.310000000000002 110.256 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.683 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 56.3 m-85 -71.63 -13.59 61.8 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.019 -0.537 . . . . 74.450000000000003 112.173 -177.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.582 ' O ' ' HE2' ' B' ' 258' ' ' MET . . . -60.47 -35.0 87.82 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.254 -0.974 . . . . 74.239999999999995 111.489 177.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 6.1 m -59.96 -30.96 69.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.814 0.34 . . . . 75.099999999999994 111.732 -177.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.0 t -102.26 16.86 24.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.056 0.455 . . . . 73.340000000000003 111.038 -176.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 22.9 t -78.01 -66.05 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.323 -0.399 . . . . 72.030000000000001 110.89 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.61 ' CD1' ' HG3' ' B' ' 261' ' ' LYS . 2.4 m-85 -135.15 -169.99 2.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.293 0.568 . . . . 74.420000000000002 112.511 -174.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.717 ' HG3' ' H ' ' B' ' 254' ' ' THR . 5.4 pt-20 -95.82 -61.16 1.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.854 -1.066 . . . . 71.150000000000006 110.154 -177.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.717 ' H ' ' HG3' ' B' ' 253' ' ' GLU . 74.8 p -89.81 154.41 19.92 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.89 -0.596 . . . . 74.120000000000005 110.461 -177.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.429 ' HE2' ' HB2' ' B' ' 255' ' ' LYS . 10.4 ptmm? -71.5 -26.82 62.84 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.753 -0.379 . . . . 72.510000000000005 110.534 -177.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.8 -51.18 70.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.045 -0.525 . . . . 71.340000000000003 110.402 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.638 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 20.5 mt-30 -77.47 -40.72 42.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 64.409999999999997 110.063 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.582 ' HE2' ' O ' ' B' ' 248' ' ' GLY . 21.5 ttt -57.79 -40.66 80.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.433 -0.803 . . . . 64.540000000000006 111.179 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.718 ' HB2' HG21 ' A' ' 85' ' ' ILE . 30.1 tt0 -71.34 -29.44 64.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.443 . . . . 74.209999999999994 111.44 -178.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.25 -15.54 59.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.011 0.434 . . . . 73.150000000000006 110.872 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.638 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.9 mmmt -95.66 -7.59 37.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.281 -0.418 . . . . 75.109999999999999 111.414 -174.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.702 ' HA ' ' HE1' ' B' ' 265' ' ' MET . 56.6 pttt -58.14 -47.08 84.43 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.432 -0.349 . . . . 71.439999999999998 110.763 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.544 ' O ' ' HB2' ' B' ' 267' ' ' ASP . 10.4 mm-40 -74.67 -16.05 60.78 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.461 -0.496 . . . . 72.200000000000003 111.623 -178.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -80.39 -32.59 37.53 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.779 -0.369 . . . . 74.5 110.407 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.702 ' HE1' ' HA ' ' B' ' 262' ' ' LYS . 15.3 ptp -89.73 -26.44 20.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.379 -0.6 . . . . 72.040000000000006 109.379 178.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.709 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 83.8 mtp -85.02 -20.68 30.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.788 -0.642 . . . . 62.119999999999997 111.615 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . 0.544 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 9.0 t70 -52.35 -47.64 65.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.485 0.66 . . . . 75.200000000000003 110.404 -175.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.454 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 8.8 p90 -96.83 0.12 48.78 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.316 -0.856 . . . . 74.030000000000001 110.858 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.454 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.2 m-30 -68.39 -50.52 52.4 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.702 -0.851 . . . . 74.439999999999998 108.702 171.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.49 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -53.36 -55.94 20.81 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.589 -0.732 . . . . 74.019999999999996 109.868 171.347 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -95.65 74.2 3.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.468 0.651 . . . . 64.129999999999995 111.385 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 4.6 mtm180 -127.71 -38.41 1.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.862 -0.608 . . . . 71.510000000000005 109.819 168.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.734 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.84 11.78 36.16 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.157 -0.474 . . . . 73.019999999999996 110.874 -176.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -64.46 -53.14 52.92 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.679 -0.408 . . . . 74.430000000000007 110.811 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.55 -35.31 80.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 62.310000000000002 110.866 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 276' ' ' MET . . . . . 0.46 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 59.8 mtt -62.73 -43.65 98.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.628 0.727 . . . . 73.0 109.927 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.623 HD22 ' HD2' ' A' ' 69' ' ' TYR . 28.3 tp -70.25 -41.45 73.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.779 -1.101 . . . . 74.299999999999997 110.514 -178.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.14 -46.49 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.544 0.687 . . . . 52.409999999999997 110.102 178.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.08 -24.02 63.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.838 -1.073 . . . . 63.32 111.669 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.41 -32.15 22.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.998 -0.281 . . . . 73.319999999999993 110.654 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.568 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -60.55 -62.92 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.051 -0.522 . . . . 75.200000000000003 110.598 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 10.6 pt-20 -74.29 -7.27 52.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.857 -0.611 . . . . 74.329999999999998 112.154 -172.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -58.63 -48.04 82.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.149 0.5 . . . . 71.319999999999993 110.051 174.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -87.5 -15.63 37.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.308 -0.405 . . . . 73.549999999999997 111.197 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.594 HD13 ' HA ' ' A' ' 59' ' ' GLN . 57.5 mt -70.35 -55.95 12.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 C-N-CA 121.019 -0.272 . . . . 72.420000000000002 110.354 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.3 pt-20 -57.8 -30.49 65.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.81 0.338 . . . . 74.129999999999995 111.383 -178.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -94.4 6.75 47.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.334 -0.394 . . . . 75.230000000000004 111.61 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.619 ' O ' ' HB2' ' B' ' 292' ' ' ARG . 69.0 t80 -57.81 -44.71 86.56 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.92 -0.4 . . . . 71.25 109.92 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -60.87 -32.67 72.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.921 0.391 . . . . 72.219999999999999 110.757 176.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -68.66 -53.77 20.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 71.420000000000002 110.052 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -64.4 -35.81 82.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 74.540000000000006 110.27 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.619 ' HB2' ' O ' ' B' ' 288' ' ' PHE . 0.1 OUTLIER -63.81 -27.84 69.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.565 -0.743 . . . . 75.439999999999998 110.265 177.753 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.17 -17.6 25.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.861 -0.609 . . . . 65.510000000000005 111.282 -176.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 20.4 p -94.32 -3.03 51.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.045 0.45 . . . . 60.530000000000001 111.189 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.41 ' O ' ' HD2' ' B' ' 296' ' ' LYS . 0.0 OUTLIER -116.36 153.36 32.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.024 -0.534 . . . . 72.510000000000005 110.552 179.279 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . 0.41 ' HD2' ' O ' ' B' ' 295' ' ' GLN . 30.2 mmmt . . . . . 0 C--O 1.249 1.027 0 CA-C-N 115.239 -0.891 . . . . 72.209999999999994 109.265 178.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.0 p . . . . . 0 N--CA 1.474 0.755 0 CA-C-O 120.636 0.255 . . . . 73.109999999999999 110.702 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -129.5 10.07 5.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.022 0.439 . . . . 75.319999999999993 111.077 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.4 p-10 -148.02 151.7 36.18 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.224 -0.444 . . . . 73.319999999999993 109.986 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -84.13 -77.29 0.27 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.58 -0.282 . . . . 61.240000000000002 111.253 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -105.34 -50.73 3.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.276 0.56 . . . . 70.519999999999996 109.845 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.557 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -97.28 161.52 13.76 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.476 -0.784 . . . . 64.319999999999993 110.863 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.443 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -78.75 53.76 1.41 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.832 -0.622 . . . . 62.340000000000003 112.091 -179.121 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.433 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 28.6 m-85 -53.79 -41.32 67.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.973 0.416 . . . . 71.409999999999997 110.961 -178.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.93 -5.02 31.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.8 -0.636 . . . . 71.329999999999998 112.24 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -99.37 -61.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.771 -0.455 . . . . 75.5 109.771 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.547 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -55.32 -23.51 24.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.731 -0.668 . . . . 71.030000000000001 112.682 -178.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.0 t -65.26 -25.58 67.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.473 0.178 . . . . 71.25 111.06 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.8 mt-10 -82.16 -33.23 29.62 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.519 0.676 . . . . 71.349999999999994 109.183 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.547 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.73 -45.15 91.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.913 -1.04 . . . . 72.299999999999997 109.443 177.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.506 HG21 ' HD2' ' B' ' 243' ' ' TYR . 71.9 mt -68.91 -31.38 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.615 -0.72 . . . . 75.209999999999994 110.682 176.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.48 -38.59 81.24 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.19 -0.459 . . . . 72.209999999999994 110.828 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.602 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 2.0 tm? -67.63 -39.74 84.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 64.540000000000006 110.135 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.574 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -61.2 -25.52 67.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.255 0.55 . . . . 71.549999999999997 110.739 177.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.407 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 22.8 m-80 -80.51 -19.97 44.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.987 -0.551 . . . . 71.329999999999998 110.141 178.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.602 ' HG2' ' HA ' ' A' ' 17' ' ' LEU . 27.6 mm-40 -68.33 -51.38 45.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.411 0.624 . . . . 72.239999999999995 109.522 177.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -73.82 -14.69 61.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.159 -0.928 . . . . 74.310000000000002 110.362 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -81.18 -11.64 59.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.744 -0.662 . . . . 63.350000000000001 110.854 -178.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 8.6 mm-40 -78.88 64.02 3.73 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.295 0.569 . . . . 73.219999999999999 110.352 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -147.55 149.36 32.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.502 -0.772 . . . . 74.510000000000005 109.053 -178.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.2 t -103.54 -31.77 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 111.979 0.362 . . . . 74.129999999999995 111.979 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -87.29 2.69 49.45 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.155 0.428 . . . . 73.299999999999997 112.155 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.92 148.93 16.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.8 -0.445 . . . . 73.200000000000003 109.8 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.482 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 2.3 mp0 -83.45 146.79 28.21 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.993 -0.548 . . . . 72.239999999999995 109.631 178.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 38.8 m -59.04 -34.79 72.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.125 0.488 . . . . 63.43 110.785 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.86 -11.57 73.94 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.746 -0.661 . . . . 73.140000000000001 113.32 -177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 13.3 mm-40 -74.54 -23.31 58.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.297 0.57 . . . . 74.400000000000006 110.037 -179.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.574 HG11 ' O ' ' A' ' 18' ' ' ALA . 21.2 t -87.3 -39.08 12.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.636 -0.711 . . . . 74.540000000000006 109.834 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -57.56 -42.05 82.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.688 -0.687 . . . . 73.040000000000006 110.746 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.11 -31.28 72.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 74.239999999999995 110.908 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 50.0 m -66.96 -32.3 73.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.159 0.504 . . . . 74.409999999999997 109.901 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.486 ' CD1' HD11 ' B' ' 214' ' ' LEU . 7.1 t80 -68.47 -37.68 80.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 74.109999999999999 109.854 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.751 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 8.5 ttm -66.86 -45.22 78.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 73.209999999999994 111.324 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.654 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 23.7 t-105 -63.1 -38.21 90.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.988 0.423 . . . . 75.129999999999995 110.565 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.509 ' HB1' ' HB3' ' B' ' 211' ' ' ALA . . . -66.39 -36.8 83.76 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.07 -0.514 . . . . 73.349999999999994 111.242 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 61.4 tp -67.68 -35.52 79.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.946 -0.391 . . . . 75.299999999999997 109.946 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.422 ' HB2' ' HA ' ' B' ' 277' ' ' LEU . . . -61.0 -43.59 98.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.81 -0.632 . . . . 73.209999999999994 110.9 178.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -69.88 -39.15 76.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.025 0.441 . . . . 75.129999999999995 110.708 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -72.41 -32.07 66.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.975 -0.557 . . . . 71.319999999999993 110.497 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB3' HD12 ' B' ' 277' ' ' LEU . 7.1 t-20 -77.31 -39.28 48.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.003 -0.544 . . . . 74.439999999999998 110.722 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.74 -27.59 69.3 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.12 0.486 . . . . 74.319999999999993 111.006 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 18.6 t90 -58.55 -27.77 64.88 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.253 -0.885 . . . . 74.129999999999995 111.072 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.83 -1.72 40.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.544 -0.298 . . . . 74.310000000000002 111.639 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.09 -27.53 69.06 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.463 -0.875 . . . . 72.299999999999997 111.37 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.415 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 33.9 p -67.34 -17.7 64.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 71.129999999999995 111.572 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 p -94.52 0.69 55.47 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.958 0.409 . . . . 74.120000000000005 110.894 -177.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.4 t -81.17 -39.03 26.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 63.109999999999999 111.59 -175.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -154.13 -179.05 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.246 0.461 . . . . 73.310000000000002 112.246 -175.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG3' ' N ' ' A' ' 54' ' ' THR . 8.9 pt-20 -101.79 -47.32 4.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.41 -0.814 . . . . 75.129999999999995 111.284 -176.315 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.442 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 51.9 p -96.41 154.77 17.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.511 -0.313 . . . . 72.230000000000004 110.358 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.497 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 17.1 ptmt -68.42 -31.16 70.3 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.844 -0.343 . . . . 75.129999999999995 110.287 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.442 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.7 mp0 -58.21 -52.24 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.281 0.562 . . . . 75.319999999999993 110.606 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.665 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 21.8 mt-30 -76.91 -36.64 56.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.746 -0.661 . . . . 71.540000000000006 110.541 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.415 ' HE2' ' HA ' ' A' ' 49' ' ' SER . 22.7 ttt -64.86 -43.36 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 74.109999999999999 111.092 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.589 ' HG3' ' HZ1' ' A' ' 62' ' ' LYS . 32.5 tt0 -61.56 -38.68 88.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.021 -0.536 . . . . 74.230000000000004 111.406 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.21 -8.7 57.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.714 -175.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.665 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.2 mmmm -104.02 -0.24 29.05 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 120.881 -0.328 . . . . 73.329999999999998 111.119 -175.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.589 ' HZ1' ' HG3' ' A' ' 59' ' ' GLN . 6.6 ptpp? -59.52 -48.44 81.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.695 -0.402 . . . . 73.120000000000005 110.607 -176.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.583 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.1 tp60 -73.4 -24.52 60.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.961 -0.385 . . . . 64.319999999999993 109.961 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -71.35 -43.45 66.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 74.299999999999997 111.19 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.58 ' HE1' ' HA ' ' A' ' 62' ' ' LYS . 22.2 ptp -75.19 -34.34 61.51 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.911 -0.774 . . . . 63.109999999999999 108.911 -179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.601 ' HE3' ' HB2' ' B' ' 278' ' ' ASP . 63.9 mtp -82.15 1.28 37.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.508 -0.769 . . . . 75.010000000000005 111.289 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 26.1 t0 -78.86 -27.47 44.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.987 0.422 . . . . 75.329999999999998 110.512 -175.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.617 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 24.6 p90 -119.38 -8.59 10.03 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.652 -0.419 . . . . 75.510000000000005 111.258 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.2 m-30 -54.57 -48.34 72.2 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.625 0.25 . . . . 75.400000000000006 111.472 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.781 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -52.3 -57.54 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.994 -0.548 . . . . 74.450000000000003 111.54 177.875 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.468 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 9.1 t70 -91.47 62.74 4.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.952 -0.567 . . . . 62.329999999999998 111.066 -172.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 4.2 mmp_? -120.12 -38.01 2.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 75.450000000000003 110.923 175.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.799 ' HE1' ' HA ' ' B' ' 270' ' ' MET . 0.1 OUTLIER -90.22 12.2 18.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.129 0.49 . . . . 73.140000000000001 109.726 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -51.81 -66.86 0.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.834 -1.076 . . . . 73.329999999999998 111.098 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.0 -23.16 64.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.75 -0.659 . . . . 73.430000000000007 112.266 -174.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.44 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 28.2 mtm -78.13 -28.14 48.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.297 0.57 . . . . 75.530000000000001 109.619 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.753 HD21 ' HE3' ' A' ' 81' ' ' MET . 6.6 tt -76.08 -37.59 58.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.438 -0.801 . . . . 75.209999999999994 108.887 174.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.644 ' HB2' ' HE2' ' B' ' 266' ' ' MET . 11.3 t70 -55.76 -39.33 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.055 -0.975 . . . . 71.420000000000002 111.069 178.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.96 -20.32 66.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.283 -0.871 . . . . 73.019999999999996 111.974 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -104.3 -4.47 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 121.065 -0.254 . . . . 63.25 111.382 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.753 ' HE3' HD21 ' A' ' 77' ' ' LEU . 9.5 mmt -71.56 -35.41 70.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.637 -0.256 . . . . 72.049999999999997 111.611 -178.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.896 ' HA ' HD13 ' A' ' 85' ' ' ILE . 41.2 mt-10 -72.58 4.03 4.34 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.003 0.371 . . . . 74.219999999999999 112.003 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.531 ' O ' ' HB2' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.34 127.2 30.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.401 -0.592 . . . . 63.020000000000003 109.401 170.848 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.531 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 23.0 m-85 77.5 -0.12 2.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.83 -1.077 . . . . 74.519999999999996 110.997 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.896 HD13 ' HA ' ' A' ' 82' ' ' GLU . 11.2 mt -92.68 -66.02 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.108 -0.496 . . . . 75.310000000000002 109.687 176.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.26 -18.54 65.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.269 0.557 . . . . 74.109999999999999 110.151 176.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -100.8 0.6 39.02 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.617 -0.72 . . . . 73.5 111.152 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.76 -47.6 85.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 120.589 0.233 . . . . 75.540000000000006 110.614 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -56.41 -24.11 42.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 62.109999999999999 111.412 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -85.3 -55.03 4.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.198 -0.456 . . . . 74.230000000000004 109.924 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -61.42 -40.82 95.83 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.798 0.332 . . . . 72.510000000000005 111.36 -179.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 6.3 tmm_? -65.84 -17.2 64.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.883 -0.599 . . . . 62.520000000000003 109.809 -178.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -95.04 -39.87 9.94 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.959 -0.564 . . . . 64.420000000000002 110.572 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 96' ' ' LYS . 41.5 p -83.59 -1.61 54.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.804 -0.634 . . . . 73.439999999999998 112.228 -176.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -59.87 139.51 57.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.132 0.492 . . . . 73.140000000000001 110.558 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 94' ' ' THR . 95.8 mttt . . . . . 0 C--N 1.321 -0.647 0 CA-C-N 115.829 -0.623 . . . . 74.120000000000005 110.506 -175.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.198 0.523 . . . . 72.430000000000007 109.987 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -90.97 19.08 5.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.498 0.666 . . . . 71.519999999999996 109.266 173.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.569 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 84.4 m-20 -111.2 179.33 4.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.105 -0.952 . . . . 72.239999999999995 111.482 -172.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -120.68 -58.69 1.81 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.32 -0.855 . . . . 75.239999999999995 109.677 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -122.03 -49.06 2.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.104 0.478 . . . . 73.129999999999995 110.28 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.485 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -99.85 166.63 10.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.798 -0.637 . . . . 73.239999999999995 111.74 -177.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.569 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -78.84 53.99 1.47 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 74.040000000000006 111.708 178.126 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -54.49 -45.6 73.28 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 72.209999999999994 111.753 -176.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.5 -15.34 62.56 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.431 0.53 . . . . 70.019999999999996 112.431 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -87.74 -62.33 1.52 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.576 0.227 . . . . 75.129999999999995 110.506 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.791 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -57.6 -18.91 22.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.877 0.695 . . . . 72.219999999999999 112.877 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 212' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 13.6 t -66.76 -23.16 66.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.695 0.284 . . . . 73.019999999999996 110.738 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.444 ' HB2' HD13 ' A' ' 17' ' ' LEU . 79.4 mt-10 -84.55 -27.46 27.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.387 0.613 . . . . 71.530000000000001 109.379 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.791 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -67.23 -47.27 71.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.202 -0.908 . . . . 73.019999999999996 109.598 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 74.6 mt -68.9 -30.92 48.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.661 -0.699 . . . . 74.549999999999997 110.27 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' B' ' 212' ' ' THR . 10.2 tmtt? -56.31 -40.03 73.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.796 -0.638 . . . . 74.439999999999998 110.88 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.525 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -64.61 -45.21 87.9 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.576 -0.527 . . . . 73.409999999999997 109.576 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.85 -37.08 78.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.98 -0.555 . . . . 72.319999999999993 110.835 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -74.52 11.56 0.98 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.053 -0.521 . . . . 71.219999999999999 111.757 178.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.11 -37.72 6.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.16 0.505 . . . . 73.409999999999997 109.733 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -76.83 -38.32 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 71.540000000000006 110.835 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . 0.549 ' ND2' ' HA ' ' B' ' 229' ' ' THR . 3.8 t-20 -71.29 -14.59 62.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.63 -0.714 . . . . 71.219999999999999 111.55 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -74.71 1.22 12.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.453 -0.34 . . . . 65.129999999999995 111.315 -176.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.525 HD21 HG13 ' B' ' 227' ' ' ILE . 1.4 t30 -77.69 103.95 7.94 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.61 -0.885 . . . . 72.200000000000003 108.61 174.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.9 t -58.64 -36.66 74.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.594 -0.73 . . . . 73.450000000000003 112.888 -172.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -82.57 9.55 9.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.964 0.357 . . . . 74.319999999999993 111.964 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.525 HG13 HD21 ' B' ' 224' ' ' ASN . 4.5 mt -117.28 152.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 109.768 -0.456 . . . . 72.319999999999993 109.768 175.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.0 154.43 28.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.087 -0.506 . . . . 71.239999999999995 110.169 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 229' ' ' THR . . . . . 0.549 ' HA ' ' ND2' ' B' ' 222' ' ' ASN . 5.5 m -64.43 -30.81 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.978 0.418 . . . . 65.540000000000006 110.501 179.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -68.05 -18.15 70.58 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.825 -0.625 . . . . 75.25 113.318 -178.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -71.23 -20.21 62.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.991 0.424 . . . . 72.049999999999997 111.078 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . 0.448 HG21 ' CA ' ' B' ' 222' ' ' ASN . 28.6 t -99.12 -36.76 5.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.085 -0.507 . . . . 75.310000000000002 110.478 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 35.9 p -64.16 -40.99 97.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.03 0.443 . . . . 64.310000000000002 110.52 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.38 73.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.989 -0.55 . . . . 61.439999999999998 110.554 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.401 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 56.4 m -68.12 -36.49 79.82 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.744 -0.465 . . . . 54.0 109.744 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.518 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.53 -40.73 85.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.751 -0.659 . . . . 75.450000000000003 109.58 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.794 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 14.8 ttm -66.25 -44.13 84.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.685 -0.689 . . . . 74.319999999999993 111.457 178.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.443 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 22.7 t-105 -64.31 -38.91 92.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.329999999999998 110.445 176.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.501 ' HB2' ' HB2' ' A' ' 11' ' ' ALA . . . -64.7 -39.08 93.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 111.065 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.17 -35.83 78.65 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.615 -0.513 . . . . 74.409999999999997 109.615 177.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.408 ' HB3' ' HB2' ' A' ' 73' ' ' TYR . . . -62.88 -30.65 71.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.175 -0.466 . . . . 62.119999999999997 111.406 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -88.59 -33.25 17.74 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.871 -0.332 . . . . 74.040000000000006 110.949 179.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.506 ' HD2' HG21 ' A' ' 15' ' ' ILE . 10.7 t80 -81.56 -39.64 24.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.392 -0.367 . . . . 72.400000000000006 111.233 -175.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -78.82 -17.43 55.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.047 0.451 . . . . 75.099999999999994 110.975 -175.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -74.75 -13.95 60.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.233 0.539 . . . . 72.420000000000002 110.57 177.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -60.63 -25.93 66.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.513 -0.767 . . . . 71.540000000000006 110.533 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -72.77 -8.63 56.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.862 -0.608 . . . . 73.450000000000003 111.762 -179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.73 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.03 -36.4 67.34 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.508 -0.853 . . . . 74.219999999999999 111.816 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 43.9 p -69.8 -13.63 62.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.815 0.34 . . . . 75.120000000000005 111.831 -177.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 40.0 p -93.03 -9.82 38.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.39 . . . . 72.409999999999997 110.784 -178.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.7 t -76.5 -36.56 57.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.244 -0.435 . . . . 51.530000000000001 110.772 -175.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -148.88 -178.5 6.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.126 0.489 . . . . 72.120000000000005 111.919 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.512 ' HG3' HG22 ' B' ' 254' ' ' THR . 10.3 pt-20 -103.93 -33.41 8.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.136 -0.938 . . . . 74.310000000000002 111.779 -172.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.529 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 43.2 p -115.09 158.48 22.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.869 -0.605 . . . . 75.450000000000003 110.158 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.77 -36.06 79.81 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 121.052 -0.259 . . . . 72.109999999999999 110.792 -178.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . 0.529 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.6 mp0 -58.27 -50.97 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.282 0.563 . . . . 73.25 110.188 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.601 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 23.9 mt-30 -73.05 -40.86 64.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.471 -0.786 . . . . 75.209999999999994 110.82 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.592 ' HE3' ' C ' ' B' ' 248' ' ' GLY . 20.1 ttt -63.88 -47.38 80.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 74.319999999999993 111.24 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.543 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.7 tt0 -62.0 -34.48 76.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 72.340000000000003 110.909 -178.191 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.32 -6.77 48.24 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.113 -0.494 . . . . 45.240000000000002 111.58 -178.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.601 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 13.9 mmmm -114.59 5.49 15.47 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 122.362 -0.211 . . . . 62.450000000000003 110.608 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.613 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 1.6 ptpp? -52.55 -48.34 66.19 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 123.314 0.384 . . . . 64.409999999999997 110.785 -177.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.421 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 16.1 tp60 -77.78 -28.36 50.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.99 0.424 . . . . 74.219999999999999 110.055 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.67 -38.17 83.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.748 -0.66 . . . . 72.219999999999999 111.187 -177.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.73 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 16.8 ptp -84.44 -26.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.307 0.575 . . . . 74.109999999999999 109.83 -177.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.644 ' HE2' ' HB2' ' A' ' 78' ' ' ASP . 75.0 mtp -79.1 -20.46 48.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.643 -0.708 . . . . 74.530000000000001 111.758 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.41 -34.95 74.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 75.200000000000003 111.369 -168.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -102.79 -10.61 18.97 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.787 -0.365 . . . . 74.439999999999998 111.179 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -60.35 -48.13 83.08 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.477 0.18 . . . . 71.329999999999998 111.173 -178.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.799 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -51.65 -51.77 53.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.059 -0.519 . . . . 75.519999999999996 111.088 177.067 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . 0.645 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 10.4 t70 -92.2 28.75 1.81 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.831 -0.622 . . . . 45.109999999999999 111.558 -171.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -84.28 -48.28 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.945 -0.472 . . . . 73.540000000000006 110.765 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.781 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -83.85 10.49 9.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.113 -0.494 . . . . 74.510000000000005 110.981 -174.822 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.735 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 14.4 tttp -56.07 -60.57 3.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.946 -0.57 . . . . 75.409999999999997 110.782 -177.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . 0.465 ' HG3' ' N ' ' B' ' 276' ' ' MET . 6.0 pt-20 -56.82 -39.83 74.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.602 -0.726 . . . . 74.120000000000005 111.842 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 276' ' ' MET . . . . . 0.654 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 49.3 mtm -74.66 -26.21 59.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.044 0.45 . . . . 52.509999999999998 110.548 -176.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.458 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 5.2 tt -72.41 -41.69 65.96 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.711 -0.848 . . . . 75.549999999999997 108.711 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.601 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 8.7 t70 -61.37 -38.68 87.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.237 -0.892 . . . . 71.019999999999996 110.815 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -64.39 -17.35 63.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.656 -0.702 . . . . 52.340000000000003 111.779 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -101.09 -3.37 29.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.758 0.313 . . . . 71.530000000000001 111.283 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 20.1 mmt -76.38 -176.03 3.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.242 -0.435 . . . . 73.420000000000002 110.675 176.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.733 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 4.0 mm-40 61.54 14.81 6.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.483 -0.78 . . . . 75.109999999999999 111.901 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -66.76 -58.84 4.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.201 -0.454 . . . . 63.539999999999999 110.676 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -89.29 -7.46 55.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.977 0.417 . . . . 73.239999999999995 110.002 174.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.733 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 42.7 mt -75.44 -57.88 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.087 -0.506 . . . . 74.319999999999993 111.318 -175.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.5 pt-20 -73.03 -16.71 61.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.838 0.351 . . . . 72.530000000000001 110.595 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -109.19 22.19 16.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.289 -0.414 . . . . 74.299999999999997 110.516 -179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.497 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 25.3 t80 -58.6 -56.78 17.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.47 -0.332 . . . . 75.329999999999998 110.826 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -60.42 -21.19 61.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.536 -0.302 . . . . 73.519999999999996 111.364 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -69.77 -57.61 4.9 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.778 -0.452 . . . . 73.129999999999995 109.778 178.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -70.67 -28.61 64.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.067 -0.515 . . . . 72.439999999999998 110.495 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 7.8 tmm_? -72.0 -15.09 62.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.455 -0.793 . . . . 71.239999999999995 110.03 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.08 -39.05 12.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.042 0.449 . . . . 72.439999999999998 110.264 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 39.7 p -94.14 22.84 5.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.879 -0.6 . . . . 73.519999999999996 111.197 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -72.55 135.27 45.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.766 -0.652 . . . . 72.099999999999994 110.602 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 96.0 mttt . . . . . 0 C--N 1.314 -0.964 0 CA-C-O 118.296 -0.859 . . . . 74.200000000000003 109.757 -178.976 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 120.619 0.247 . . . . 74.109999999999999 110.36 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -81.39 -12.51 58.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.041 0.448 . . . . 72.129999999999995 110.233 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.665 ' HA ' ' HB2' ' A' ' 8' ' ' TYR . 1.6 p-10 -148.65 121.12 8.5 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.759 -0.83 . . . . 74.310000000000002 108.759 170.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.429 ' H ' ' HD2' ' A' ' 8' ' ' TYR . 24.8 mt-10 -104.33 79.08 1.55 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.25 -0.432 . . . . 71.040000000000006 111.544 -175.01 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.43 24.67 8.77 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.125 0.965 . . . . 75.219999999999999 108.735 175.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -158.3 174.91 14.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.41 -1.268 . . . . 74.230000000000004 110.222 -171.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.434 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -91.49 42.4 1.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.308 -0.405 . . . . 74.439999999999998 111.526 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.665 ' HB2' ' HA ' ' A' ' 3' ' ' ASN . 44.5 m-85 -53.34 -46.3 69.46 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.413 -0.358 . . . . 74.510000000000005 111.193 178.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.12 -14.91 62.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.95 -0.568 . . . . 55.229999999999997 111.914 -178.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 0.6 OUTLIER -95.36 -58.02 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.257 -0.275 . . . . 74.040000000000006 110.257 178.905 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.834 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -57.16 -23.14 45.44 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.688 0.625 . . . . 73.519999999999996 112.688 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 t -65.39 -24.01 67.11 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.941 0.401 . . . . 72.409999999999997 110.801 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 35.9 mt-10 -81.34 -23.28 37.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.332 0.586 . . . . 73.209999999999994 109.878 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.834 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -71.14 -41.68 70.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.333 -0.848 . . . . 75.030000000000001 109.591 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.413 HG21 ' HD2' ' B' ' 243' ' ' TYR . 71.4 mt -72.67 -20.58 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.657 -0.701 . . . . 75.310000000000002 110.192 177.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 15.7 mmmt -57.96 -40.08 79.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.708 -0.678 . . . . 74.230000000000004 111.851 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.526 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.7 tm? -74.98 -29.73 60.98 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.267 0.556 . . . . 72.439999999999998 109.527 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.415 ' O ' HG13 ' A' ' 32' ' ' VAL . . . -70.4 -42.95 71.02 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.585 -0.734 . . . . 71.519999999999996 110.698 -175.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.647 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.8 m-20 -57.05 -42.45 80.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.893 -0.594 . . . . 72.219999999999999 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.92 -33.96 75.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.939 -0.573 . . . . 75.519999999999996 111.745 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -77.62 -27.99 51.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.001 0.429 . . . . 74.200000000000003 110.199 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.593 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 3.4 t-20 -74.7 -20.28 59.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.94 -0.573 . . . . 74.140000000000001 110.383 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.647 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 9.9 mm-40 -71.91 -15.58 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.962 -0.563 . . . . 64.219999999999999 111.296 -178.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.637 ' HB3' HG13 ' A' ' 27' ' ' ILE . 10.7 t30 -66.69 123.51 20.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.963 0.411 . . . . 74.299999999999997 110.569 -177.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.2 t -56.98 -37.2 71.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.368 -0.833 . . . . 75.439999999999998 113.039 -175.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -82.74 -24.09 33.71 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.852 0.316 . . . . 75.0 111.852 -173.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.637 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.5 mt -90.68 145.11 7.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.095 0.474 . . . . 72.420000000000002 110.276 -174.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.693 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 33.4 mt-30 -83.73 152.65 24.59 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.322 -0.854 . . . . 74.329999999999998 109.358 177.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.593 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 30.2 m -58.3 -37.7 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.033 0.445 . . . . 72.0 110.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.827 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -69.39 -19.08 74.08 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.6 -0.727 . . . . 73.420000000000002 114.078 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.693 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 33.7 mm-40 -74.92 -36.09 62.17 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 117.588 0.694 . . . . 71.310000000000002 109.606 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.476 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.5 t -71.92 -41.04 69.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.312 -0.858 . . . . 74.420000000000002 110.353 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -59.38 -37.08 77.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.714 -0.675 . . . . 73.209999999999994 110.369 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.64 -31.48 65.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.798 -0.637 . . . . 72.010000000000005 110.872 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.479 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 10.3 t -68.33 -37.54 80.64 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.694 -0.484 . . . . 72.0 109.694 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.599 ' HD1' HD11 ' B' ' 214' ' ' LEU . 13.7 t80 -66.89 -37.47 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 74.450000000000003 109.545 176.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.706 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.4 ttm -67.33 -46.63 72.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 64.040000000000006 111.412 178.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.628 ' HE3' ' HB3' ' B' ' 276' ' ' MET . 35.8 t-105 -62.24 -39.93 94.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.739 0.304 . . . . 73.420000000000002 110.727 177.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.522 ' HB3' ' HB2' ' B' ' 211' ' ' ALA . . . -63.14 -37.89 88.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.362 -0.381 . . . . 74.439999999999998 111.038 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.741 HD23 ' SD ' ' B' ' 237' ' ' MET . 56.4 tp -64.94 -37.93 89.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 120.955 0.407 . . . . 74.409999999999997 110.075 178.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.549 ' HB1' ' HA ' ' B' ' 277' ' ' LEU . . . -63.16 -35.41 80.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.797 -0.638 . . . . 74.430000000000007 111.25 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 38' ' ' TRP . 55.9 mtp180 -74.81 -37.45 62.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.258 0.551 . . . . 74.120000000000005 110.142 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -77.39 -41.25 40.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.471 -0.786 . . . . 75.530000000000001 110.911 -175.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -66.05 -34.74 78.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.945 -0.57 . . . . 72.5 110.862 -175.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.414 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -62.37 -11.07 13.44 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.851 -0.613 . . . . 71.209999999999994 112.471 -177.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -63.27 -26.99 69.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.666 0.27 . . . . 73.329999999999998 111.087 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -66.53 -11.87 54.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.446 -0.343 . . . . 65.400000000000006 111.856 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.449 ' O ' ' HE3' ' A' ' 58' ' ' MET . . . -60.48 -28.01 66.78 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.274 -0.965 . . . . 75.430000000000007 111.233 174.023 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.9 m -64.17 -15.83 60.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.474 0.31 . . . . 73.540000000000006 111.657 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.9 t -119.15 22.19 11.95 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.153 0.501 . . . . 72.140000000000001 110.698 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.1 t -84.59 -60.88 1.93 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.45 -0.341 . . . . 74.329999999999998 110.814 178.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.519 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.8 m-85 -146.48 -175.29 4.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.814 0.34 . . . . 75.319999999999993 111.387 -177.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -102.1 -33.13 9.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.575 -0.739 . . . . 65.019999999999996 111.241 -174.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 p -113.01 153.02 28.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.897 -0.592 . . . . 73.010000000000005 110.804 -178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -67.37 -34.04 76.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.403 -0.362 . . . . 70.239999999999995 110.755 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.23 -36.44 84.15 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.247 -0.433 . . . . 75.030000000000001 111.001 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.647 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 mt-30 -84.84 -40.16 17.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.448 -0.342 . . . . 74.409999999999997 110.468 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.459 ' SD ' HG12 ' B' ' 285' ' ' ILE . 19.4 ttt -64.4 -45.1 89.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.234 -0.439 . . . . 73.010000000000005 111.425 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.584 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.2 tt0 -64.25 -33.44 75.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 73.439999999999998 110.993 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.47 -17.84 62.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.238 -0.437 . . . . 75.209999999999994 110.898 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.3 mmmt -100.44 -2.3 33.62 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.262 -0.426 . . . . 73.120000000000005 109.904 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.743 ' HA ' ' HE2' ' A' ' 65' ' ' MET . 27.2 ttpp -53.54 -51.77 61.84 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.239 -0.437 . . . . 72.450000000000003 111.31 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -80.41 -11.22 59.72 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.318 -0.553 . . . . 65.319999999999993 110.45 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -83.49 -27.78 29.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.312 -0.404 . . . . 74.209999999999994 110.012 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.743 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 19.0 ptp -88.9 -33.23 17.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.353 -0.981 . . . . 73.010000000000005 108.353 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.686 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 61.6 mtp -85.56 14.66 5.34 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 115.402 -0.817 . . . . 74.329999999999998 111.144 178.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -87.37 -39.57 15.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.182 0.515 . . . . 74.200000000000003 110.321 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.635 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 39.2 p90 -103.59 -9.89 18.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.098 -0.501 . . . . 73.420000000000002 111.758 -173.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.6 m-30 -56.74 -48.94 76.67 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.864 0.364 . . . . 73.430000000000007 110.902 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.84 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.24 -47.03 72.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.53 0.681 . . . . 74.409999999999997 110.101 176.459 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -82.93 34.49 0.45 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.017 -0.992 . . . . 73.150000000000006 110.975 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.665 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 2.1 mmp_? -107.76 -32.57 7.57 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.982 -0.449 . . . . 75.230000000000004 110.995 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.774 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -107.08 3.61 26.04 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.348 -0.541 . . . . 72.129999999999995 110.027 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.83 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 82.2 tttt -63.96 -54.04 40.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.025 -0.534 . . . . 74.329999999999998 110.748 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -62.6 -24.79 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.906 -0.588 . . . . 65.239999999999995 111.499 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.599 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 64.1 mtm -90.89 -23.0 20.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.022 0.439 . . . . 75.420000000000002 110.456 -179.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.404 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 6.2 tt -73.16 -38.65 66.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.755 -0.832 . . . . 72.239999999999995 108.755 176.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.597 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 26.8 t70 -60.32 -31.88 70.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.321 -0.854 . . . . 72.150000000000006 110.588 178.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.59 -14.29 60.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.602 -0.726 . . . . 73.420000000000002 111.621 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -97.44 -9.96 26.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.224 0.535 . . . . 71.129999999999995 110.641 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.433 ' C ' ' H ' ' A' ' 83' ' ' ASP . 22.5 mmt -75.45 -169.64 1.05 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.891 -0.595 . . . . 74.340000000000003 110.276 174.418 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.558 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 64.17 -11.03 0.13 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.876 1.065 . . . . 74.310000000000002 113.876 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.433 ' H ' ' C ' ' A' ' 81' ' ' MET . 32.0 t70 -53.57 -62.64 1.52 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.735 0.302 . . . . 52.329999999999998 111.457 -178.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -81.99 5.68 18.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.756 0.313 . . . . 72.510000000000005 111.019 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.585 HG21 ' HB2' ' B' ' 259' ' ' GLN . 51.6 mt -97.74 -59.7 3.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.42 -0.354 . . . . 75.140000000000001 111.258 -175.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.4 pt-20 -71.88 -18.49 62.04 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.567 -0.453 . . . . 73.439999999999998 110.884 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -97.37 1.39 49.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.278 -0.419 . . . . 71.439999999999998 110.481 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -63.01 -38.43 91.18 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.658 -0.497 . . . . 73.430000000000007 109.658 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -53.63 -35.86 61.4 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.622 -0.717 . . . . 72.219999999999999 110.432 174.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -76.95 -53.24 8.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.582 -0.735 . . . . 72.540000000000006 110.317 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -58.22 -46.78 85.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.477 . . . . 75.129999999999995 111.41 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 tpp180 -67.86 -14.98 63.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.957 -0.565 . . . . 75.450000000000003 110.867 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -91.78 -34.01 14.76 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.139 -0.482 . . . . 71.150000000000006 110.748 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.7 p -78.52 -18.4 54.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.045 -0.525 . . . . 74.239999999999995 112.074 -177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -98.56 129.2 45.1 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.38 0.609 . . . . 73.439999999999998 110.865 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 115.535 -0.757 . . . . 74.140000000000001 110.981 -176.83 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.455 -0.186 0 N-CA-C 110.115 -0.328 . . . . 74.409999999999997 110.115 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -88.08 -10.83 48.9 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.399 0.618 . . . . 72.549999999999997 110.378 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 26.1 p-10 -112.44 159.61 18.57 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.362 -0.835 . . . . 73.25 110.458 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . 0.518 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . 42.3 tt0 -114.2 74.27 0.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.168 0.508 . . . . 54.240000000000002 110.545 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 68.55 19.95 8.53 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.095 -0.957 . . . . 71.120000000000005 109.54 173.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.501 ' HB2' ' CE2' ' B' ' 208' ' ' TYR . . . -151.53 167.04 29.29 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.291 -0.868 . . . . 74.430000000000007 111.325 -170.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.479 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -90.59 45.65 1.28 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.811 -0.631 . . . . 71.340000000000003 111.066 -179.154 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.518 ' CE2' ' HB3' ' B' ' 204' ' ' GLU . 69.3 m-85 -49.07 -49.54 41.05 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.357 -0.383 . . . . 65.150000000000006 111.476 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.44 -34.8 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.142 -0.481 . . . . 70.519999999999996 111.819 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 10.5 mmp_? -68.69 -59.27 3.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.462 -0.335 . . . . 62.25 110.223 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.733 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -61.92 -17.66 57.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.888 -0.597 . . . . 72.329999999999998 111.593 -176.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 212' ' ' THR . . . . . 0.499 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 24.3 m -60.43 -34.4 73.93 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.633 -0.712 . . . . 72.230000000000004 110.921 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.487 ' HB2' HD12 ' A' ' 17' ' ' LEU . 32.2 mt-10 -81.1 -25.42 36.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 63.240000000000002 110.18 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.733 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.7 mm? -66.52 -41.22 89.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.641 -0.708 . . . . 74.530000000000001 110.209 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.406 HG13 ' HB1' ' A' ' 39' ' ' ALA . 93.2 mt -73.99 -18.58 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.898 -0.592 . . . . 72.109999999999999 111.194 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' B' ' 212' ' ' THR . 31.2 mmmt -62.47 -40.53 96.95 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.042 -0.411 . . . . 74.340000000000003 111.043 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.516 ' O ' HD12 ' B' ' 217' ' ' LEU . 2.2 tm? -65.79 -34.78 78.96 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.391 -0.596 . . . . 73.140000000000001 109.391 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.14 93.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.885 -0.598 . . . . 74.420000000000002 110.36 -178.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.558 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 24.4 m-80 -60.84 -35.07 75.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.961 -0.563 . . . . 73.430000000000007 110.678 178.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.08 -28.69 63.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 75.219999999999999 111.663 -179.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -84.22 -22.66 30.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.403 0.621 . . . . 64.430000000000007 110.032 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . 0.472 ' HA ' HG22 ' B' ' 232' ' ' VAL . 3.3 t-20 -75.84 -8.56 57.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.271 -0.877 . . . . 73.400000000000006 109.94 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.558 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 10.9 mm-40 -83.32 1.23 42.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.793 -0.64 . . . . 62.549999999999997 110.653 177.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.448 HD21 HG13 ' B' ' 227' ' ' ILE . 1.0 OUTLIER -89.33 111.62 22.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.356 -0.383 . . . . 73.120000000000005 110.157 -178.306 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.0 t -65.59 -36.69 84.5 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.986 0.736 . . . . 74.439999999999998 112.986 -173.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.69 -9.94 59.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.091 0.404 . . . . 63.520000000000003 112.091 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.539 HG21 ' HB2' ' B' ' 231' ' ' GLU . 7.0 mt -101.15 145.06 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.541 -0.54 . . . . 73.120000000000005 109.541 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.733 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 38.0 mt-30 -78.55 150.45 32.83 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.958 -0.564 . . . . 75.340000000000003 109.726 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -35.92 72.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.912 0.387 . . . . 53.439999999999998 110.519 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.71 -16.5 76.14 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.791 -0.641 . . . . 70.239999999999995 113.355 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.733 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 9.3 mm-40 -76.87 -31.33 56.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 117.477 0.639 . . . . 72.209999999999994 110.103 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . 0.472 HG22 ' HA ' ' B' ' 222' ' ' ASN . 22.0 t -72.05 -31.51 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.699 0.761 . . . . 73.319999999999993 109.762 178.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.14 -29.47 66.4 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.521 -0.763 . . . . 73.349999999999994 109.665 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.39 -33.41 37.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.592 -0.731 . . . . 73.040000000000006 111.424 -177.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 10.5 p -66.53 -36.74 83.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.096 -0.335 . . . . 71.200000000000003 110.096 178.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.569 ' CD1' HD12 ' A' ' 14' ' ' LEU . 3.2 t80 -65.78 -38.06 87.99 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.381 -0.6 . . . . 73.299999999999997 109.381 174.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.774 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.2 tpt -61.4 -54.38 44.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.232 -0.894 . . . . 72.430000000000007 110.639 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.599 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 27.2 t-105 -64.01 -36.58 84.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.517 -0.765 . . . . 71.310000000000002 111.421 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -62.01 -43.46 98.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.658 0.266 . . . . 72.109999999999999 110.744 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.418 HD23 ' HE3' ' A' ' 37' ' ' MET . 56.8 tp -63.01 -37.94 89.2 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.481 -0.327 . . . . 74.209999999999994 110.446 176.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.549 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -57.91 -39.99 79.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.475 -0.33 . . . . 52.450000000000003 111.347 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -75.02 -43.14 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.306 0.574 . . . . 74.420000000000002 110.283 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.413 ' HD2' HG21 ' A' ' 15' ' ' ILE . 14.5 t80 -69.81 -30.25 67.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.497 -0.774 . . . . 71.5 110.895 -175.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -79.87 -38.52 32.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.045 -0.525 . . . . 75.450000000000003 111.082 -175.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.14 -18.52 48.2 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.97 -0.559 . . . . 64.140000000000001 111.834 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -54.79 -34.22 62.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.789 -0.641 . . . . 73.230000000000004 111.227 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.827 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 41.5 m-85 -67.5 -15.08 63.48 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 112.12 0.415 . . . . 75.349999999999994 112.12 -176.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.624 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -55.99 -31.09 58.33 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.596 -0.812 . . . . 64.340000000000003 112.143 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 62.2 p -74.19 -14.23 60.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.722 0.296 . . . . 74.430000000000007 111.455 -177.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 34.0 p -98.21 -5.96 32.24 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.848 0.356 . . . . 64.239999999999995 111.119 -176.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 67.3 m -78.89 -41.97 28.38 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 116.137 -0.483 . . . . 73.409999999999997 111.647 -175.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.61 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 3.0 m-85 -147.06 176.61 9.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.235 0.457 . . . . 73.409999999999997 112.235 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -101.09 -46.6 5.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.36 -0.836 . . . . 75.549999999999997 111.611 -172.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 40.9 p -100.63 151.19 21.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.52 -0.309 . . . . 75.219999999999999 110.287 -177.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -63.29 -36.29 83.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.126 -0.488 . . . . 74.510000000000005 111.075 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.74 -29.36 69.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.027 -0.533 . . . . 73.040000000000006 111.075 -176.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.744 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 25.6 mt-30 -91.25 -45.04 8.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 71.450000000000003 110.159 177.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.486 ' HE2' ' C ' ' B' ' 248' ' ' GLY . 16.8 ttt -60.5 -41.93 95.3 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.952 -0.567 . . . . 73.140000000000001 111.552 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.585 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.6 tt0 -64.48 -40.09 95.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.83 0.348 . . . . 74.129999999999995 111.329 -178.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.54 -4.78 24.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.174 0.512 . . . . 73.420000000000002 110.954 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.744 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 71.9 mmtt -108.35 4.85 24.93 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.059 -0.519 . . . . 74.430000000000007 110.61 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.562 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 2.6 ptpp? -60.18 -49.46 77.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.399 -0.52 . . . . 72.319999999999993 110.225 -177.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.562 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 7.2 tp-100 -86.02 -1.32 57.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.555 0.693 . . . . 72.340000000000003 110.074 -179.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . 0.41 ' HB3' ' O ' ' B' ' 261' ' ' LYS . 4.1 tp10 -79.74 -43.44 22.59 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.821 -0.627 . . . . 74.219999999999999 109.324 173.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.624 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 3.8 ptt? -86.37 -31.62 21.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.941 0.4 . . . . 74.140000000000001 110.204 177.462 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.597 ' HE3' ' HB2' ' A' ' 78' ' ' ASP . 60.6 mtp -77.31 7.84 4.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.403 -0.362 . . . . 73.150000000000006 110.952 177.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -78.79 -42.6 27.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.095 0.474 . . . . 65.430000000000007 110.067 176.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.9 p90 -107.65 -12.93 15.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 73.319999999999993 111.751 -172.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 -51.88 -51.6 55.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.791 0.329 . . . . 74.319999999999993 111.199 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.84 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.87 -49.04 78.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.365 0.603 . . . . 75.310000000000002 110.228 177.316 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -87.27 42.02 1.01 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.207 -0.906 . . . . 61.539999999999999 110.647 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -104.61 -42.3 5.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.419 -0.355 . . . . 60.43 110.455 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.706 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -93.32 9.65 35.4 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.503 -0.479 . . . . 75.299999999999997 110.769 -175.531 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.509 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 28.9 ttmt -63.93 -48.75 75.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.929 0.395 . . . . 74.230000000000004 110.426 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -67.66 -25.88 65.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.448 0.642 . . . . 75.030000000000001 110.737 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 276' ' ' MET . . . . . 0.628 ' HB3' ' HE3' ' A' ' 38' ' ' TRP . 56.0 mmm -83.45 -28.12 29.01 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.265 -0.88 . . . . 74.019999999999996 109.792 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.686 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 1.9 tt -72.62 -41.74 65.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.353 -0.84 . . . . 74.420000000000002 108.946 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -61.01 -31.43 71.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.504 -0.771 . . . . 74.010000000000005 110.123 176.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -71.94 -7.52 49.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.265 -0.88 . . . . 75.209999999999994 111.848 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -114.35 -8.22 12.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.95 0.405 . . . . 74.430000000000007 110.96 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.554 ' C ' ' H ' ' B' ' 283' ' ' ASP . 39.9 mtt -87.85 -162.77 0.85 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.269 -0.423 . . . . 75.400000000000006 110.248 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.62 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 5.0 mm-40 65.43 -22.9 0.09 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.79 0.836 . . . . 74.430000000000007 112.75 -176.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . 0.554 ' H ' ' C ' ' B' ' 281' ' ' MET . 20.6 t70 -48.03 -63.48 1.06 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.322 0.649 . . . . 74.239999999999995 111.883 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -68.0 -32.15 72.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.029 0.442 . . . . 55.210000000000001 110.813 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.584 HG21 ' HB2' ' A' ' 59' ' ' GLN . 46.0 mt -65.25 -56.96 12.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.666 -0.697 . . . . 75.230000000000004 111.52 -173.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 13.4 pt-20 -65.72 -21.01 66.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.848 0.356 . . . . 74.200000000000003 110.906 -177.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -102.1 9.18 40.47 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 74.329999999999998 112.272 -177.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -58.38 -52.94 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.53 -0.468 . . . . 73.209999999999994 110.325 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -68.54 -18.3 64.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 74.450000000000003 110.954 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -72.67 -56.48 5.24 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.865 -0.607 . . . . 64.319999999999993 109.877 173.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -64.0 -43.13 96.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.925 0.393 . . . . 73.519999999999996 110.907 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.607 ' HA ' ' HG2' ' B' ' 295' ' ' GLN . 8.0 tpp180 -73.95 -0.64 16.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.216 0.532 . . . . 75.030000000000001 110.959 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -96.33 -23.04 16.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.096 0.474 . . . . 64.510000000000005 110.449 174.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.6 p -90.85 -12.72 35.44 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.433 0.635 . . . . 75.109999999999999 110.221 176.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.607 ' HG2' ' HA ' ' B' ' 292' ' ' ARG . 19.2 pt20 -123.28 176.32 6.18 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.338 -0.986 . . . . 75.340000000000003 108.338 175.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt . . . . . 0 C--N 1.314 -0.946 0 CA-C-O 118.707 -0.663 . . . . 74.430000000000007 110.421 -178.51 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 121.296 0.57 . . . . 73.310000000000002 110.696 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -148.86 -53.07 0.17 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.455 -0.943 . . . . 70.430000000000007 108.455 174.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.491 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.9 p-10 -123.42 120.6 33.45 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.786 -0.643 . . . . 73.519999999999996 109.29 174.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -63.8 -57.59 9.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.613 -0.721 . . . . 74.120000000000005 110.517 -178.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -136.96 -56.61 0.72 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.987 0.423 . . . . 74.420000000000002 109.998 175.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -68.25 167.1 15.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.78 -0.646 . . . . 75.310000000000002 111.652 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.411 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -79.1 49.56 0.96 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.219 -0.9 . . . . 72.340000000000003 111.845 -178.127 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -53.31 -42.42 66.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 75.510000000000005 110.972 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.4 -9.38 47.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.68 -0.691 . . . . 74.439999999999998 112.222 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.455 ' HE ' ' HA ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -98.54 -62.21 1.27 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.745 -0.465 . . . . 74.209999999999994 109.745 178.598 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.675 ' HA ' HD22 ' A' ' 14' ' ' LEU . . . -55.24 -23.88 24.8 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.743 0.646 . . . . 73.439999999999998 112.743 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.7 t -66.43 -24.92 66.53 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.738 0.304 . . . . 72.400000000000006 110.887 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.561 ' HB2' HD11 ' B' ' 217' ' ' LEU . 31.2 mt-10 -80.75 -31.17 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.481 0.658 . . . . 73.400000000000006 109.528 -177.879 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.675 HD22 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -67.16 -48.73 67.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.03 -0.986 . . . . 75.019999999999996 110.144 -178.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.438 HG13 ' HB3' ' B' ' 239' ' ' ALA . 77.0 mt -65.82 -29.11 45.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 75.340000000000003 110.53 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -25.88 65.37 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.98 -0.555 . . . . 74.129999999999995 110.681 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.52 HD12 HD13 ' B' ' 214' ' ' LEU . 2.4 tm? -75.42 -45.94 35.76 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.86 -0.792 . . . . 64.239999999999995 108.86 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.438 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -59.87 -37.54 79.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.519 0.676 . . . . 73.209999999999994 109.692 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -56.58 -30.39 63.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.775 -1.102 . . . . 51.140000000000001 110.529 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -78.24 -35.07 48.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.772 . . . . 74.140000000000001 110.992 -176.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -79.2 -23.33 43.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.196 -0.456 . . . . 74.219999999999999 110.999 -176.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -86.89 7.51 26.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.238 0.542 . . . . 75.239999999999995 110.499 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 -79.3 8.24 6.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 73.040000000000006 111.184 177.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.766 ' HB3' HG13 ' A' ' 27' ' ' ILE . 3.3 t30 -101.94 111.9 24.33 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.426 -0.583 . . . . 73.129999999999995 109.426 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.6 t -56.03 -33.51 64.99 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.382 -0.826 . . . . 73.540000000000006 112.626 -175.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -95.68 13.79 25.23 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.438 0.533 . . . . 75.140000000000001 112.438 -173.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.766 HG13 ' HB3' ' A' ' 24' ' ' ASN . 5.7 mt -111.78 150.25 14.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.542 -0.54 . . . . 74.420000000000002 109.542 172.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.846 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 42.6 mt-30 -72.47 144.26 48.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.958 -0.564 . . . . 74.25 109.976 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 m -63.66 -26.32 68.61 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.228 -0.656 . . . . 61.240000000000002 109.228 175.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.467 ' HA2' ' OG ' ' A' ' 33' ' ' SER . . . -78.65 -8.03 87.87 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.195 -0.912 . . . . 63.100000000000001 113.122 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.846 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 12.6 mm-40 -78.64 -25.72 45.04 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.437 0.619 . . . . 74.430000000000007 109.859 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.438 HG11 ' O ' ' A' ' 18' ' ' ALA . 16.2 t -93.46 -31.49 4.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.353 -0.84 . . . . 75.530000000000001 110.762 -176.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.467 ' OG ' ' HA2' ' A' ' 30' ' ' GLY . 10.2 p -66.71 -37.15 84.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.245 0.545 . . . . 70.129999999999995 109.844 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.9 65.05 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.474 -0.785 . . . . 73.439999999999998 111.446 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.503 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 20.1 p -70.54 -31.79 68.97 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.905 0.383 . . . . 60.039999999999999 110.187 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.601 ' CD1' HD11 ' B' ' 214' ' ' LEU . 9.9 t80 -68.81 -41.35 78.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.879 -0.6 . . . . 75.329999999999998 109.456 174.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.731 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.1 ttm -64.06 -47.42 80.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.549 -0.75 . . . . 75.319999999999993 111.158 177.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.7 t-105 -61.31 -37.43 83.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.067 0.46 . . . . 75.439999999999998 110.751 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.57 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -68.93 -34.13 74.87 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.277 -0.42 . . . . 71.019999999999996 111.199 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.598 HD22 ' SD ' ' B' ' 237' ' ' MET . 48.8 tp -68.9 -35.94 77.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.017 0.437 . . . . 74.400000000000006 110.222 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.03 -42.87 99.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.869 -0.605 . . . . 73.120000000000005 110.72 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 47.7 mtm180 -71.94 -19.98 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 75.450000000000003 111.036 -179.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -89.18 -42.13 11.84 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.307 -0.406 . . . . 74.239999999999995 110.462 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -69.71 -23.54 63.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 71.420000000000002 111.568 -179.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.37 61.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.144 0.497 . . . . 73.239999999999995 111.477 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -68.63 -31.46 70.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.025 -0.534 . . . . 71.430000000000007 110.881 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.447 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 91.1 m-85 -79.01 2.37 20.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.187 -0.461 . . . . 73.439999999999998 112.049 -173.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.43 ' C ' ' HE2' ' A' ' 58' ' ' MET . . . -59.03 -34.51 79.48 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.486 -0.864 . . . . 73.129999999999995 112.101 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.481 ' HA ' ' HE2' ' A' ' 58' ' ' MET . 13.7 p -74.36 -14.83 60.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.765 0.317 . . . . 71.519999999999996 111.597 -177.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -88.5 -4.04 58.69 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.734 -0.386 . . . . 72.120000000000005 110.713 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.0 t -84.82 -36.97 21.28 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.371 -0.377 . . . . 74.140000000000001 110.756 -176.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -151.5 178.2 9.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.98 0.419 . . . . 75.409999999999997 111.311 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG3' HG22 ' A' ' 54' ' ' THR . 8.5 pt-20 -99.43 -50.11 4.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.581 -0.736 . . . . 75.109999999999999 110.985 -176.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.401 HG22 ' HG3' ' A' ' 53' ' ' GLU . 63.0 p -92.25 150.52 20.83 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.156 -0.475 . . . . 74.129999999999995 110.323 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.438 ' HE2' ' HB2' ' A' ' 55' ' ' LYS . 11.2 ptmm? -68.09 -27.98 66.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.714 -0.394 . . . . 73.310000000000002 110.142 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -56.15 -54.84 40.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 73.319999999999993 110.465 177.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.548 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.4 mt-30 -77.38 -34.43 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.824 -0.625 . . . . 74.109999999999999 110.31 -177.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.481 ' HE2' ' HA ' ' A' ' 49' ' ' SER . 20.4 ttt -63.68 -44.61 93.19 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.467 -0.788 . . . . 72.409999999999997 111.079 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.511 ' O ' ' HD2' ' A' ' 62' ' ' LYS . 35.6 tt0 -68.47 -28.6 67.18 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 73.340000000000003 111.234 -176.354 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.6 -6.68 51.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.494 -0.321 . . . . 44.530000000000001 111.801 -177.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 11.3 mmmm -112.83 10.06 19.06 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.683 -0.488 . . . . 72.409999999999997 109.683 -176.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.511 ' HD2' ' O ' ' A' ' 59' ' ' GLN . 9.6 ptmt -51.27 -41.16 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.379 -0.828 . . . . 74.340000000000003 111.421 -177.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.4 ' NE2' ' HA ' ' A' ' 63' ' ' GLN . 11.1 tp60 -87.76 -30.39 20.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.512 0.196 . . . . 74.109999999999999 110.622 -175.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.08 -37.17 86.14 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 116.377 -0.374 . . . . 71.030000000000001 111.302 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.433 ' HA ' ' CE2' ' A' ' 68' ' ' TYR . 23.2 ptp -83.27 -31.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.77 -0.826 . . . . 73.150000000000006 108.77 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.648 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 21.3 mtp -86.63 33.86 0.65 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.306 -0.861 . . . . 73.439999999999998 112.456 -176.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -129.13 -46.27 1.23 Allowed 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.165 -0.614 . . . . 74.430000000000007 109.949 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.433 ' CE2' ' HA ' ' A' ' 65' ' ' MET . 16.3 p90 -72.42 -17.07 61.83 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.742 -0.383 . . . . 72.129999999999995 110.028 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.711 ' HA ' ' HD3' ' A' ' 72' ' ' ARG . 6.2 m-30 -58.21 -50.5 73.33 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.766 -0.457 . . . . 74.530000000000001 109.766 174.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.624 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.36 -47.11 79.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.669 0.747 . . . . 74.209999999999994 109.467 174.444 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -80.0 31.42 0.26 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.58 -1.191 . . . . 73.129999999999995 111.437 -176.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.711 ' HD3' ' HA ' ' A' ' 69' ' ' TYR . 4.8 mtp180 -103.19 -29.75 11.11 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.662 -0.649 . . . . 72.319999999999993 111.452 -176.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.891 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -115.95 14.65 16.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.325 -0.55 . . . . 74.239999999999995 111.493 -177.746 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.767 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 42.6 tttp -63.34 -50.83 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.457 -0.572 . . . . 74.230000000000004 109.457 179.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.9 -30.79 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.841 -0.618 . . . . 73.420000000000002 111.272 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.4 mtt -69.46 -41.25 76.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.235 0.54 . . . . 72.329999999999998 109.571 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.698 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.6 tt -68.92 -31.78 70.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.99 -1.005 . . . . 74.409999999999997 109.095 -179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -61.86 -34.4 75.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.112 -0.949 . . . . 73.230000000000004 110.912 177.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.05 -4.2 46.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 65.120000000000005 111.1 -178.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.23 -31.18 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.099 0.476 . . . . 74.400000000000006 109.85 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.562 ' HG3' ' SD ' ' B' ' 266' ' ' MET . 25.0 mmt -68.82 176.32 3.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.457 -0.792 . . . . 74.319999999999993 110.663 174.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.556 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 9.6 mm-40 65.29 -30.6 0.13 Allowed 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.331 1.053 . . . . 73.420000000000002 113.19 -177.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.501 ' H ' ' C ' ' A' ' 81' ' ' MET . 22.7 t70 -57.76 -64.02 1.04 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.9 0.381 . . . . 73.319999999999993 110.851 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -68.15 -14.66 63.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.379 . . . . 72.25 110.953 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.537 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 63.3 mt -81.49 -57.71 4.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 75.219999999999999 111.025 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.5 pt-20 -58.48 -34.68 71.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.931 0.396 . . . . 72.230000000000004 110.428 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.42 ' N ' ' HG3' ' A' ' 86' ' ' GLU . 50.6 m-80 -88.11 -0.55 57.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.049 -0.523 . . . . 74.430000000000007 111.462 -177.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.461 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 83.9 t80 -61.34 -43.51 98.75 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 120.4 -0.52 . . . . 75.430000000000007 109.863 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.21 -31.66 71.43 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 74.340000000000003 110.238 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -69.98 -52.44 24.27 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.62 -0.718 . . . . 72.420000000000002 109.865 177.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -59.58 -47.36 85.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.209 0.528 . . . . 65.430000000000007 110.885 178.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -69.98 -11.06 60.6 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.534 -0.757 . . . . 74.150000000000006 110.559 -177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -91.76 -34.97 14.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.957 0.408 . . . . 62.229999999999997 110.461 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 33.1 p -72.95 -25.73 61.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.141 -0.481 . . . . 75.299999999999997 111.634 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -92.83 152.18 19.58 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.101 -0.333 . . . . 64.209999999999994 110.101 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 46.5 mtmt . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 116.248 -0.433 . . . . 71.409999999999997 111.092 -176.622 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.452 -0.358 0 CA-C-O 121.07 0.462 . . . . 75.200000000000003 110.177 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -124.63 157.8 34.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.838 -0.619 . . . . 73.219999999999999 109.551 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.545 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.2 p-10 -70.35 149.68 47.09 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.13 0.491 . . . . 72.540000000000006 111.114 -176.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -81.39 -90.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.805 -0.634 . . . . 75.030000000000001 111.365 -175.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -102.53 -36.83 8.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.285 0.564 . . . . 63.009999999999998 109.846 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.545 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -97.82 150.75 20.93 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.473 -0.785 . . . . 74.409999999999997 110.74 176.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.503 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -75.85 54.77 0.84 Allowed 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.659 -1.155 . . . . 73.409999999999997 112.121 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -52.8 -43.39 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.414 -0.357 . . . . 74.209999999999994 111.094 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -68.03 -10.77 56.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.824 -0.625 . . . . 75.239999999999995 112.086 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.495 ' HE ' ' HA ' ' B' ' 210' ' ' ARG . 1.1 mmp_? -96.13 -60.83 1.55 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.921 -0.4 . . . . 73.209999999999994 109.921 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.669 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -57.24 -20.6 28.4 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.807 0.669 . . . . 65.409999999999997 112.807 -176.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.26 -24.54 65.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.794 0.33 . . . . 71.230000000000004 111.038 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.431 ' HB2' HD13 ' A' ' 17' ' ' LEU . 41.8 mt-10 -87.34 -24.04 24.41 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.13 0.491 . . . . 75.319999999999993 109.962 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.669 HD21 ' HA ' ' B' ' 211' ' ' ALA . 3.8 mm? -68.88 -49.1 61.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.538 -0.755 . . . . 65.530000000000001 110.334 -178.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.57 HG13 ' HB2' ' A' ' 39' ' ' ALA . 65.2 mt -68.86 -25.23 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.01 0.433 . . . . 75.5 110.385 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.9 OUTLIER -59.0 -36.07 74.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.048 -0.524 . . . . 74.109999999999999 110.439 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.561 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.3 tm? -65.89 -43.55 87.95 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.096 -0.705 . . . . 74.030000000000001 109.096 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.09 66.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 75.310000000000002 110.678 178.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 12.6 m120 -62.09 -35.09 77.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.008 -0.542 . . . . 75.329999999999998 110.247 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . 0.45 HE22 ' HD3' ' B' ' 216' ' ' LYS . 2.6 mp0 -74.33 -24.96 59.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.195 -0.457 . . . . 75.019999999999996 111.216 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . 0.42 ' HB2' HG12 ' B' ' 232' ' ' VAL . 62.7 mt-30 -86.85 -27.43 23.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.994 0.426 . . . . 72.450000000000003 110.33 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.17 -1.88 46.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.859 -0.61 . . . . 71.519999999999996 110.744 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.8 mm-40 -69.96 -17.52 63.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.108 0.48 . . . . 74.219999999999999 110.388 176.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.633 HD21 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -79.6 124.53 28.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.965 -0.561 . . . . 73.340000000000003 110.109 176.101 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.7 t -99.86 -17.32 17.69 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.09 -0.505 . . . . 74.540000000000006 110.232 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . 0.633 ' HG2' HD21 ' B' ' 224' ' ' ASN . 2.0 pm0 -80.64 -6.42 58.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 75.540000000000006 110.932 176.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.426 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.2 mt -111.96 153.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.467 -0.568 . . . . 74.030000000000001 109.467 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.19 142.21 49.05 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.064 -0.347 . . . . 75.310000000000002 110.064 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.1 m -62.22 -24.08 67.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.523 0.678 . . . . 75.430000000000007 109.981 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . 0.447 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.32 -32.16 83.28 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.383 -0.826 . . . . 74.409999999999997 112.676 178.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -65.09 -32.54 74.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.889 0.376 . . . . 75.430000000000007 110.673 -177.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . 0.42 HG12 ' HB2' ' B' ' 221' ' ' GLN . 11.8 t -75.09 -29.27 21.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 74.140000000000001 110.657 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 72.3 p -74.63 -24.96 58.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.437 0.637 . . . . 72.219999999999999 109.493 175.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.81 -33.91 34.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.446 -0.797 . . . . 75.519999999999996 110.906 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 5.3 p -67.61 -36.63 81.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 120.898 0.38 . . . . 72.299999999999997 110.071 177.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.573 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 2.1 t80 -68.39 -36.01 78.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 74.230000000000004 109.406 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.891 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.3 tpt -63.31 -56.41 16.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.251 -0.886 . . . . 64.519999999999996 110.527 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.3 t-105 -60.53 -35.61 76.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.206 -0.906 . . . . 72.420000000000002 111.103 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.438 ' HB3' HG13 ' A' ' 15' ' ' ILE . . . -65.99 -43.22 88.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.418 -0.355 . . . . 74.299999999999997 111.338 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.18 -34.81 78.45 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.733 0.301 . . . . 73.420000000000002 110.489 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.9 79.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 74.219999999999999 111.102 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . 0.403 HH21 HD13 ' A' ' 15' ' ' ILE . 28.6 mtm180 -70.45 -27.81 64.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 75.040000000000006 111.125 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . 0.438 ' HD2' HG22 ' A' ' 15' ' ' ILE . 8.8 t80 -80.86 -34.86 33.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 72.299999999999997 110.349 -178.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -75.95 -35.82 59.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.029 -0.532 . . . . 72.129999999999995 110.852 -176.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.37 -22.69 63.59 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.967 -0.561 . . . . 74.219999999999999 111.798 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.5 t90 -55.19 -33.86 63.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.99 -0.55 . . . . 75.319999999999993 111.443 179.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -74.58 -7.46 53.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 75.340000000000003 111.975 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.456 ' C ' ' HE1' ' B' ' 258' ' ' MET . . . -65.14 -34.59 90.08 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.271 -0.966 . . . . 74.310000000000002 111.491 176.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.2 m -71.22 -9.69 58.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.76 0.314 . . . . 70.340000000000003 111.681 -177.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.4 t -119.74 16.77 12.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 74.530000000000001 110.388 178.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.6 t -90.22 -27.45 19.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.054 0.454 . . . . 74.319999999999993 109.941 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -146.06 170.41 16.71 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.222 -0.659 . . . . 73.420000000000002 109.222 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.552 ' HG3' HG21 ' B' ' 254' ' ' THR . 10.1 pt-20 -89.41 -37.38 14.87 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.787 -0.365 . . . . 74.109999999999999 111.557 -175.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.552 HG21 ' HG3' ' B' ' 253' ' ' GLU . 72.7 p -110.94 159.75 17.43 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 123.166 0.292 . . . . 75.150000000000006 110.535 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.606 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 12.0 ptmm? -74.79 -26.14 59.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.847 -0.427 . . . . 72.439999999999998 109.847 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -54.47 -42.7 70.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 72.430000000000007 110.619 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.555 ' O ' ' HG3' ' B' ' 261' ' ' LYS . 15.9 mt-30 -91.48 -37.12 13.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.763 -0.653 . . . . 70.450000000000003 110.394 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.606 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 17.9 ttt -60.56 -40.85 93.14 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.078 -0.51 . . . . 70.140000000000001 111.712 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.472 ' HB2' HG21 ' A' ' 85' ' ' ILE . 31.5 tt0 -72.33 -31.17 65.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.067 -0.515 . . . . 73.310000000000002 111.844 -174.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -79.31 -13.42 59.66 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.266 0.555 . . . . 71.0 110.984 -167.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.612 ' HD3' ' C ' ' B' ' 261' ' ' LYS . 0.0 OUTLIER -126.78 26.37 6.22 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 115.67 -0.695 . . . . 74.530000000000001 112.138 -175.512 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.707 ' HA ' ' HE2' ' B' ' 265' ' ' MET . 0.0 OUTLIER -59.17 -35.0 72.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 109.907 175.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.421 ' N ' ' HG2' ' B' ' 262' ' ' LYS . 12.7 tp60 -73.09 -25.56 60.93 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.329 -0.396 . . . . 74.430000000000007 111.434 -176.31 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -57.47 -55.16 38.37 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.219 0.533 . . . . 73.329999999999998 110.309 176.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.707 ' HE2' ' HA ' ' B' ' 262' ' ' LYS . 2.2 ptt? -72.33 -34.79 68.32 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.955 -0.566 . . . . 74.219999999999999 109.909 -177.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.698 ' HE1' ' HB3' ' A' ' 77' ' ' LEU . 26.5 mtp -79.98 19.36 0.71 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.923 -0.581 . . . . 74.519999999999996 111.639 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.98 -44.06 3.06 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.574 -0.528 . . . . 73.329999999999998 109.574 175.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.682 ' CE2' ' HA ' ' B' ' 265' ' ' MET . 20.7 p90 -91.27 -19.41 23.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.016 -0.538 . . . . 73.530000000000001 111.561 -178.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.422 ' CE2' ' HB2' ' B' ' 265' ' ' MET . 1.6 m-30 -52.76 -48.17 66.96 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.825 0.345 . . . . 73.049999999999997 110.763 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.767 ' HE2' ' HA ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -54.05 -47.97 71.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.598 -0.728 . . . . 74.400000000000006 111.217 178.353 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.66 26.88 2.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.376 -0.829 . . . . 72.209999999999994 111.765 -168.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 12.0 mtp180 -95.66 -26.86 15.56 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.485 -0.486 . . . . 73.120000000000005 111.626 -178.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.731 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.06 11.1 37.64 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.523 -0.471 . . . . 71.209999999999994 110.45 -178.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.589 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 18.6 ttmt -65.01 -43.35 92.79 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.119 -0.491 . . . . 71.209999999999994 110.403 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.43 -39.47 93.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.651 0.263 . . . . 73.150000000000006 111.418 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.5 mtt -61.31 -46.24 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.453 0.644 . . . . 70.310000000000002 109.727 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.648 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 1.1 tt -67.58 -33.25 74.65 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.784 -1.098 . . . . 74.329999999999998 109.663 -178.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . 0.412 ' HB2' ' HE3' ' A' ' 66' ' ' MET . 19.6 t70 -64.86 -28.38 69.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.253 -0.885 . . . . 74.430000000000007 110.425 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -90.33 -2.39 57.99 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.261 -0.881 . . . . 63.420000000000002 111.092 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -104.91 -23.76 12.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 72.439999999999998 110.507 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.441 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.3 mmt -69.31 179.18 2.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.537 0.684 . . . . 71.209999999999994 111.672 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.718 ' HA ' HD12 ' B' ' 285' ' ' ILE . 30.2 mt-10 68.63 -12.29 0.37 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.326 -1.306 . . . . 74.349999999999994 112.97 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . 0.425 ' H ' ' C ' ' B' ' 281' ' ' MET . 24.5 t70 -55.96 -58.93 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 72.209999999999994 110.395 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -72.65 -16.06 61.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.165 -0.471 . . . . 75.329999999999998 110.885 178.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.718 HD12 ' HA ' ' B' ' 282' ' ' GLU . 60.9 mt -77.54 -57.08 6.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.116 -0.493 . . . . 73.129999999999995 110.551 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.2 pt-20 -67.34 -25.26 65.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 72.540000000000006 110.809 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -94.99 15.75 17.99 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.179 -0.464 . . . . 74.200000000000003 111.519 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.482 ' O ' ' HB2' ' B' ' 292' ' ' ARG . 20.2 t80 -58.12 -50.09 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.198 -0.667 . . . . 75.129999999999995 109.198 173.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -57.95 -28.24 64.13 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.667 -0.697 . . . . 71.420000000000002 111.33 175.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -74.88 -55.62 5.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.065 -0.516 . . . . 74.519999999999996 110.323 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -69.5 -38.93 77.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.246 -0.434 . . . . 72.340000000000003 111.349 -177.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' B' ' 288' ' ' PHE . 0.6 OUTLIER -65.65 -20.0 66.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.087 0.47 . . . . 74.319999999999993 109.895 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -85.53 -27.5 25.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.044 -0.525 . . . . 71.530000000000001 110.904 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.3 p -82.99 -8.71 59.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 73.439999999999998 111.186 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -116.51 160.1 21.11 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.207 -0.451 . . . . 74.329999999999998 110.356 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.293 -0.861 . . . . 73.109999999999999 109.626 -179.052 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 110.255 -0.276 . . . . 72.329999999999998 110.255 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -99.92 -86.47 0.38 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.616 0.245 . . . . 64.299999999999997 110.788 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.734 ' ND2' ' HA ' ' A' ' 7' ' ' PHE . 89.1 m-20 -127.52 170.3 12.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.116 0.484 . . . . 75.439999999999998 111.208 -176.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -97.31 -80.58 0.44 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.4 -0.963 . . . . 75.329999999999998 108.4 168.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -113.6 -47.63 2.98 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.897 -0.779 . . . . 72.450000000000003 108.897 170.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -82.82 159.49 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.408 -0.815 . . . . 72.519999999999996 111.835 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.734 ' HA ' ' ND2' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -75.82 56.36 0.94 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.87 -1.059 . . . . 65.099999999999994 112.309 179.272 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.451 ' HE1' ' HZ2' ' B' ' 238' ' ' TRP . 58.5 m-85 -56.2 -44.35 79.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.514 -0.312 . . . . 73.420000000000002 111.419 -179.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.61 61.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.339 -0.391 . . . . 73.329999999999998 111.627 -177.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -88.18 -65.23 1.04 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.397 -0.365 . . . . 72.120000000000005 110.099 177.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.652 ' HA ' HD21 ' A' ' 14' ' ' LEU . . . -58.64 -21.94 55.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 112.68 0.622 . . . . 72.010000000000005 112.68 -175.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.669 HG21 ' HG2' ' A' ' 13' ' ' GLU . 6.1 t -59.41 -28.91 67.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.136 0.494 . . . . 73.430000000000007 110.814 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.669 ' HG2' HG21 ' A' ' 12' ' ' THR . 5.4 mm-40 -92.31 -26.3 18.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.874 -0.603 . . . . 73.340000000000003 110.171 -173.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.652 HD21 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -64.51 -45.03 89.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.298 -0.864 . . . . 63.130000000000003 109.178 173.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.538 HG13 ' HB1' ' B' ' 239' ' ' ALA . 89.4 mt -69.24 -34.76 64.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.689 -0.687 . . . . 74.329999999999998 110.373 175.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -64.22 -30.83 71.87 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.849 -0.614 . . . . 64.109999999999999 111.351 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.577 HD13 HD12 ' B' ' 214' ' ' LEU . 3.1 tm? -65.04 -41.85 94.85 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.946 -0.761 . . . . 73.129999999999995 108.946 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.94 70.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.378 -0.828 . . . . 74.540000000000006 110.865 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -63.47 -26.36 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.817 -0.628 . . . . 71.239999999999995 110.978 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.407 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 2.7 mp0 -85.35 -8.61 58.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.207 -0.451 . . . . 75.430000000000007 111.194 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.419 ' OE1' HD23 ' B' ' 214' ' ' LEU . 80.8 mt-30 -104.68 -29.27 10.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.82 0.343 . . . . 74.150000000000006 110.498 177.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.425 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 2.5 t-20 -83.08 -12.47 57.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.037 0.446 . . . . 73.439999999999998 110.569 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.9 pt20 -73.45 -1.01 16.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.175 0.512 . . . . 72.030000000000001 110.326 175.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.622 ' HB3' HG13 ' A' ' 27' ' ' ILE . 2.0 t30 -82.43 108.02 15.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.832 -0.803 . . . . 55.009999999999998 108.832 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.4 t -62.03 -25.61 67.76 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 113.028 0.751 . . . . 71.329999999999998 113.028 -171.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.3 0.88 55.64 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.986 0.365 . . . . 74.540000000000006 111.986 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.622 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.1 mt -113.31 147.78 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.476 -0.564 . . . . 74.230000000000004 109.476 176.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -88.5 157.95 18.48 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.837 -0.431 . . . . 72.010000000000005 109.837 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.425 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 31.4 m -65.73 -27.54 68.39 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.107 0.48 . . . . 73.439999999999998 110.012 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.19 -29.94 76.4 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.63 -0.714 . . . . 73.510000000000005 112.669 178.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -69.96 -30.98 68.47 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.468 0.651 . . . . 72.109999999999999 109.612 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.7 t -82.1 -32.89 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.189 -0.914 . . . . 65.040000000000006 110.771 -177.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 93.2 p -65.92 -28.77 69.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.315 0.579 . . . . 65.109999999999999 109.803 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.0 -32.44 26.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.608 -0.724 . . . . 65.409999999999997 111.216 -178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.433 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 15.1 p -70.51 -36.79 73.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.971 0.415 . . . . 71.549999999999997 109.968 -178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.705 ' HD1' HD13 ' B' ' 214' ' ' LEU . 17.2 t80 -64.93 -35.29 80.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.402 0.62 . . . . 74.319999999999993 109.713 175.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.711 ' HE2' HD22 ' B' ' 240' ' ' LEU . 13.2 ttm -73.27 -47.44 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.657 -0.701 . . . . 74.319999999999993 111.529 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 14.9 t-105 -60.03 -36.63 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.919 0.39 . . . . 74.310000000000002 110.352 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.518 ' HB3' HG13 ' B' ' 215' ' ' ILE . . . -65.64 -38.09 88.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 73.510000000000005 110.862 177.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.837 HD22 ' HE2' ' B' ' 237' ' ' MET . 41.0 tp -66.35 -38.48 87.71 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 110.012 -0.366 . . . . 74.099999999999994 110.012 178.314 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.472 ' HB3' ' HB2' ' B' ' 273' ' ' TYR . . . -60.74 -28.23 68.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.34 -0.391 . . . . 74.439999999999998 111.155 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -86.12 -45.44 11.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.037 0.446 . . . . 73.329999999999998 110.665 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.445 ' HD2' HG23 ' B' ' 215' ' ' ILE . 24.5 t80 -70.22 -37.16 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.898 -0.592 . . . . 65.400000000000006 111.205 -175.678 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.7 -18.6 58.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.289 -0.414 . . . . 74.340000000000003 111.184 -174.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.557 ' HB3' HD23 ' B' ' 277' ' ' LEU . . . -78.68 -5.15 52.3 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.109 0.48 . . . . 71.420000000000002 110.968 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -57.41 -39.51 76.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.420000000000002 109.913 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -75.91 -9.08 58.31 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.903 -0.59 . . . . 74.319999999999993 111.38 -176.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.486 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.13 -38.32 92.14 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.624 -0.99 . . . . 55.310000000000002 110.624 172.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.7 m -71.74 -6.81 44.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.494 0.318 . . . . 74.310000000000002 111.581 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 6.1 t -117.44 10.98 13.75 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.209 0.528 . . . . 74.319999999999993 110.113 178.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.73 -44.24 15.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.954 -0.566 . . . . 61.020000000000003 110.236 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.542 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.1 m-85 -145.29 176.35 9.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.426 -0.352 . . . . 70.209999999999994 111.081 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -97.77 -42.29 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.712 -0.676 . . . . 71.310000000000002 111.636 -173.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 63.8 p -102.57 152.41 21.19 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.746 -0.207 . . . . 71.109999999999999 110.509 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -65.85 -32.19 73.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.083 0.468 . . . . 73.120000000000005 110.17 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -52.62 -51.32 60.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.043 -0.981 . . . . 71.519999999999996 110.606 178.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.609 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 20.9 mt-30 -87.65 -32.92 19.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.525 -0.761 . . . . 72.409999999999997 111.064 -176.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.47 ' HE3' ' O ' ' A' ' 48' ' ' GLY . 18.5 ttt -64.21 -42.43 96.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.894 0.378 . . . . 75.430000000000007 110.786 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.539 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 36.7 tt0 -65.67 -27.7 68.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 75.209999999999994 110.679 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.99 -8.45 57.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.358 -0.383 . . . . 74.310000000000002 110.778 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.609 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 29.4 mmmt -114.87 -6.62 12.62 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.35 -0.386 . . . . 73.230000000000004 111.319 -176.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.882 ' HA ' ' HE1' ' A' ' 65' ' ' MET . 56.5 pttt -65.23 -44.7 87.36 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.614 -0.435 . . . . 74.430000000000007 110.956 -172.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.411 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 9.1 tp60 -74.96 -16.99 60.62 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.921 -0.4 . . . . 73.140000000000001 109.921 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -78.82 -38.59 37.76 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.375 -0.375 . . . . 72.439999999999998 110.765 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.882 ' HE1' ' HA ' ' A' ' 62' ' ' LYS . 18.4 ptp -80.65 -27.92 37.02 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.633 -0.877 . . . . 72.019999999999996 108.633 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.635 ' HE1' ' HB3' ' B' ' 277' ' ' LEU . 45.5 mtp -90.45 9.6 28.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.994 -1.003 . . . . 72.310000000000002 111.248 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -81.36 -37.15 28.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.401 -0.592 . . . . 74.329999999999998 109.401 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.504 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 48.3 p90 -106.83 -10.1 16.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.607 -0.724 . . . . 74.120000000000005 111.327 -175.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.425 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 2.3 m-30 -55.55 -51.35 67.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.714 0.292 . . . . 75.510000000000005 110.992 -178.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.94 ' HE3' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -56.83 -41.27 77.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.704 0.764 . . . . 74.329999999999998 110.008 175.854 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -80.71 3.74 21.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.417 -1.265 . . . . 74.409999999999997 112.443 -169.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.674 ' HB2' ' SD ' ' B' ' 237' ' ' MET . 48.0 mtm180 -82.76 -41.53 19.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 121.653 -0.654 . . . . 73.329999999999998 110.621 -173.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.807 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -94.12 9.83 36.21 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.285 0.564 . . . . 64.109999999999999 109.924 -176.08 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.759 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 85.5 tttt -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.222 -0.899 . . . . 75.530000000000001 110.003 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -68.93 -30.26 68.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 75.5 110.844 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.41 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 57.1 mtt -68.26 -38.54 81.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.378 0.609 . . . . 75.5 110.064 176.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.675 ' HB3' ' HE3' ' B' ' 266' ' ' MET . 0.5 OUTLIER -72.14 -44.85 62.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.125 -0.943 . . . . 73.510000000000005 110.63 -176.531 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.63 -41.21 80.92 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.314 0.578 . . . . 65.219999999999999 110.213 -178.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.87 -20.12 65.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.078 -0.965 . . . . 74.219999999999999 111.753 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.667 ' OD1' ' HD2' ' B' ' 242' ' ' ARG . 0.8 OUTLIER -92.83 -30.35 15.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.781 0.324 . . . . 72.340000000000003 110.868 179.721 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.58 ' HE1' HD23 ' A' ' 77' ' ' LEU . 21.6 mmt -61.89 -61.96 2.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.776 -0.647 . . . . 74.340000000000003 111.226 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.578 ' HA ' HD11 ' A' ' 85' ' ' ILE . 7.4 pt-20 -70.22 -13.08 62.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.721 -0.672 . . . . 72.430000000000007 112.771 -171.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.1 -51.96 66.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.374 . . . . 72.239999999999995 110.303 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -64.95 -36.51 84.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.128 0.49 . . . . 73.329999999999998 110.0 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.874 HD13 ' HA ' ' B' ' 259' ' ' GLN . 79.3 mt -63.69 -57.16 12.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.382 -0.826 . . . . 73.129999999999995 112.136 -176.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.8 pt-20 -61.72 -32.48 72.71 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.037 -0.265 . . . . 63.450000000000003 111.084 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -93.2 5.24 52.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.342 -0.39 . . . . 72.510000000000005 111.592 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.524 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 63.7 t80 -57.36 -49.88 74.74 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 121.481 -0.088 . . . . 72.0 111.225 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.425 ' OD2' ' HD3' ' B' ' 255' ' ' LYS . 72.1 m-20 -58.47 -31.41 67.8 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.985 0.421 . . . . 73.209999999999994 110.45 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -71.11 -55.61 7.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.917 -0.583 . . . . 74.439999999999998 110.435 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.482 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 30.9 m-85 -63.37 -42.39 98.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.893 0.377 . . . . 75.25 111.202 -179.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . 0.477 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 7.5 tmm_? -67.71 -19.58 65.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.037 -0.528 . . . . 75.510000000000005 110.227 -177.698 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -82.21 -34.15 29.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.431 -0.35 . . . . 72.209999999999994 110.819 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 5.0 p -75.77 -18.81 59.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.032 0.444 . . . . 72.430000000000007 110.628 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.482 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 26.5 mt-30 -77.65 127.42 32.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.815 -0.63 . . . . 75.420000000000002 109.4 173.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt . . . . . 0 C--N 1.318 -0.769 0 CA-C-N 116.236 -0.438 . . . . 74.319999999999993 110.732 -175.209 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 21.3 m . . . . . 0 CA--C 1.531 0.216 0 CA-C-O 120.809 0.338 . . . . 73.430000000000007 111.041 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -135.64 -79.74 0.42 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.414 -0.357 . . . . 72.019999999999996 110.335 178.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.754 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 94.7 m-20 -134.19 179.17 6.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.124 -0.489 . . . . 75.120000000000005 110.281 -179.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . 0.438 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 13.6 tp10 -132.43 -77.37 0.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.092 -0.504 . . . . 75.340000000000003 110.239 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -98.92 -21.74 16.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.402 0.62 . . . . 74.549999999999997 109.769 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.489 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -148.72 168.66 22.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.565 -0.743 . . . . 74.540000000000006 112.043 -174.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.754 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -70.87 53.81 0.16 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.488 -1.233 . . . . 73.239999999999995 112.429 178.295 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.438 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 29.3 m-85 -56.24 -47.4 78.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.611 -0.268 . . . . 73.140000000000001 111.136 -178.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.94 -16.05 63.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 63.0 111.735 -176.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.629 ' HE ' ' HA ' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -88.12 -63.59 1.28 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.44 -0.345 . . . . 74.519999999999996 110.16 177.673 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.576 ' HA ' HD21 ' B' ' 214' ' ' LEU . . . -53.67 -29.65 39.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.905 0.705 . . . . 72.120000000000005 112.905 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 212' ' ' THR . . . . . 0.488 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 7.1 t -64.68 -25.01 67.76 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.675 0.274 . . . . 74.409999999999997 111.073 -177.132 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -82.3 -24.3 34.73 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.251 0.548 . . . . 73.209999999999994 109.622 -178.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.705 HD13 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -68.9 -42.63 76.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.347 -0.842 . . . . 73.010000000000005 109.279 177.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.518 HG13 ' HB3' ' A' ' 39' ' ' ALA . 87.8 mt -68.91 -28.48 39.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.423 -0.808 . . . . 72.120000000000005 110.255 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.505 ' HD2' ' HA ' ' B' ' 216' ' ' LYS . 28.4 mmmt -57.27 -47.26 81.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.349 -0.387 . . . . 73.349999999999994 111.503 178.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.504 HD13 ' O ' ' B' ' 217' ' ' LEU . 1.9 tm? -61.59 -32.17 72.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.5 -0.556 . . . . 74.120000000000005 109.5 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -68.8 -32.98 73.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.819 -0.628 . . . . 61.420000000000002 110.821 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -66.56 -31.05 71.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.877 0.37 . . . . 71.219999999999999 110.783 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.66 -4.81 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.08 -0.509 . . . . 64.109999999999999 111.175 -178.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -110.17 -17.86 13.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.529 0.68 . . . . 72.439999999999998 109.295 172.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . 0.427 ' ND2' HG23 ' B' ' 229' ' ' THR . 22.1 t-20 -78.96 -21.54 47.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.871 -1.058 . . . . 75.420000000000002 110.196 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.17 12.37 0.74 Allowed 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.671 -0.695 . . . . 73.340000000000003 111.975 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.529 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.0 OUTLIER -98.31 109.35 22.12 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 52.509999999999998 109.72 179.599 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.7 t -65.46 -28.89 69.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.488 0.551 . . . . 65.340000000000003 112.488 -173.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -87.91 4.58 44.23 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.915 0.339 . . . . 73.099999999999994 111.915 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.529 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.1 mt -117.86 161.66 16.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.149 -0.686 . . . . 61.219999999999999 109.149 174.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.716 ' N ' HE21 ' B' ' 228' ' ' GLN . 0.0 OUTLIER -105.29 152.23 23.16 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.477 -0.564 . . . . 74.530000000000001 109.477 178.554 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 229' ' ' THR . . . . . 0.427 HG23 ' ND2' ' B' ' 222' ' ' ASN . 5.0 m -55.83 -28.28 55.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.03 0.443 . . . . 72.150000000000006 110.687 179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -64.11 -22.67 67.18 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.705 -0.679 . . . . 75.430000000000007 113.22 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -83.84 -17.13 41.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.232 0.539 . . . . 64.349999999999994 110.018 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 15.2 t -90.2 -39.52 12.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 73.450000000000003 109.854 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 33.5 p -65.8 -34.36 77.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.21 0.529 . . . . 72.450000000000003 109.841 175.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -72.03 -34.33 68.72 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.571 -0.741 . . . . 75.299999999999997 111.325 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.455 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 4.0 p -75.82 -32.64 59.92 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.986 -0.376 . . . . 71.409999999999997 109.986 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.476 ' CD1' HD13 ' A' ' 14' ' ' LEU . 2.9 t80 -64.96 -39.73 93.94 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.001 -0.74 . . . . 74.239999999999995 109.001 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.837 ' HE2' HD22 ' A' ' 40' ' ' LEU . 1.2 ttm -66.65 -48.3 69.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.395 -0.82 . . . . 75.340000000000003 111.226 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.451 ' HZ2' ' HE1' ' A' ' 8' ' ' TYR . 19.2 t-105 -60.62 -44.46 96.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.395 -0.366 . . . . 75.019999999999996 110.758 177.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.538 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -61.95 -36.26 80.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.412 . . . . 75.340000000000003 111.057 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.711 HD22 ' HE2' ' A' ' 37' ' ' MET . 42.8 tp -63.52 -40.56 97.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.378 -0.374 . . . . 72.340000000000003 110.278 177.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.571 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.77 -45.1 94.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.065 0.46 . . . . 72.450000000000003 110.344 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . 0.667 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 11.1 mmm180 -58.87 -41.28 86.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 74.430000000000007 110.755 178.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -75.92 -38.22 57.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 64.040000000000006 111.028 -175.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -69.55 -31.78 70.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.887 0.328 . . . . 73.319999999999993 111.887 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . 0.502 ' HB1' HD22 ' A' ' 77' ' ' LEU . . . -72.32 -17.64 61.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 70.409999999999997 111.266 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -64.64 -23.69 67.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.614 -0.721 . . . . 74.200000000000003 109.68 175.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 0.439 ' O ' HG23 ' B' ' 250' ' ' THR . 69.1 m-85 -85.47 2.89 42.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.095 -0.502 . . . . 74.540000000000006 111.39 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.485 ' C ' ' HE2' ' B' ' 258' ' ' MET . . . -64.75 -35.87 92.44 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.237 -0.982 . . . . 65.040000000000006 111.445 175.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.0 m -62.33 -24.57 67.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.681 0.277 . . . . 71.540000000000006 111.658 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 250' ' ' THR . . . . . 0.439 HG23 ' O ' ' B' ' 247' ' ' PHE . 14.6 t -98.27 10.7 40.05 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.606 -0.438 . . . . 73.540000000000006 110.738 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 33.7 t -87.93 -54.58 4.16 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.966 -0.383 . . . . 63.119999999999997 109.966 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.627 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 2.0 m-85 -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.165 0.507 . . . . 72.540000000000006 111.736 178.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.53 ' HG3' HG22 ' B' ' 254' ' ' THR . 8.9 pt-20 -95.45 -47.22 6.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.12 -0.946 . . . . 74.329999999999998 111.628 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.53 HG22 ' HG3' ' B' ' 253' ' ' GLU . 65.2 p -102.67 161.85 13.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.572 -0.285 . . . . 71.420000000000002 110.501 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.8 ptmt -72.38 -29.8 64.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.877 -0.329 . . . . 74.409999999999997 110.503 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -61.05 -41.7 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.938 -0.574 . . . . 50.329999999999998 110.574 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.596 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 23.3 mt-30 -86.81 -39.75 15.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.922 -0.581 . . . . 74.519999999999996 110.809 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.485 ' HE2' ' C ' ' B' ' 248' ' ' GLY . 13.3 ttt -63.81 -35.8 81.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.404 -0.362 . . . . 75.030000000000001 111.194 -178.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.874 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.9 tt0 -62.52 -40.85 98.08 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.934 0.397 . . . . 74.230000000000004 111.073 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -71.35 -9.12 57.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.836 -0.62 . . . . 64.140000000000001 111.183 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.627 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 31.5 mmmt -107.99 -3.44 18.79 Favored 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 111.947 0.351 . . . . 74.329999999999998 111.947 -173.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.555 ' HA ' ' HE2' ' B' ' 265' ' ' MET . 50.9 pttt -59.51 -49.73 76.65 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.217 -0.593 . . . . 74.319999999999993 110.401 -177.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . 0.498 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 17.8 tp60 -67.46 -23.19 65.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.873 0.368 . . . . 61.039999999999999 110.568 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -82.45 -34.24 28.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.192 -0.458 . . . . 73.439999999999998 111.535 -178.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.555 ' HE2' ' HA ' ' B' ' 262' ' ' LYS . 21.6 ptp -83.88 -25.34 30.31 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.883 -0.784 . . . . 73.219999999999999 108.883 179.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.675 ' HE3' ' HB3' ' A' ' 77' ' ' LEU . 56.1 mtp -85.83 -12.33 51.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.096 -0.956 . . . . 74.209999999999994 110.664 177.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -54.02 -41.35 67.92 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.099 -0.5 . . . . 53.210000000000001 111.087 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.558 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 17.9 p90 -105.89 -6.11 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.667 -0.697 . . . . 72.430000000000007 110.601 -175.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.478 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 1.4 m-30 -59.3 -54.06 51.13 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.641 -0.254 . . . . 75.400000000000006 110.477 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.861 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.98 -47.88 61.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.305 0.574 . . . . 71.219999999999999 110.207 174.492 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -86.05 23.68 1.46 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.113 -0.949 . . . . 72.129999999999995 112.272 -169.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.558 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 36.2 mtm180 -95.24 -28.84 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.382 -0.824 . . . . 73.209999999999994 111.576 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.596 ' HB3' ' CG ' ' A' ' 37' ' ' MET . 0.1 OUTLIER -112.2 13.04 20.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.175 0.512 . . . . 71.129999999999995 110.195 -178.689 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . 0.94 ' HA ' ' HE3' ' A' ' 70' ' ' MET . 81.8 tttt -64.34 -51.98 60.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.648 -0.705 . . . . 72.530000000000001 110.843 -176.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.5 -30.75 68.68 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.926 0.393 . . . . 74.409999999999997 110.676 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.0 -39.77 93.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.759 -0.655 . . . . 71.319999999999993 110.13 177.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.635 ' HB3' ' HE1' ' A' ' 66' ' ' MET . 0.5 OUTLIER -67.99 -40.03 83.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.481 -0.782 . . . . 73.120000000000005 110.57 -176.45 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.06 -34.87 78.51 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.025 0.44 . . . . 64.230000000000004 110.68 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.63 65.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 72.239999999999995 110.886 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -91.42 -29.28 17.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 74.439999999999998 110.124 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.584 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.9 mmt -61.54 -60.21 4.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 75.329999999999998 109.78 173.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.675 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 72.8 mm-40 -57.23 -22.6 42.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.595 -0.729 . . . . 71.510000000000005 111.926 -177.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -47.83 -50.37 26.33 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.436 0.46 . . . . 52.450000000000003 110.867 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -100.15 -10.61 21.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.369 -0.378 . . . . 75.200000000000003 111.729 178.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.675 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 68.1 mt -74.25 -55.25 12.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.726 -0.39 . . . . 65.430000000000007 110.503 177.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.649 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.1 pt-20 -66.18 -34.74 78.72 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.678 -0.409 . . . . 75.340000000000003 110.524 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.11 8.37 33.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.357 -0.383 . . . . 61.100000000000001 111.361 -178.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.85 -56.14 24.11 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.064 -0.347 . . . . 75.409999999999997 110.064 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -74.58 6.07 4.18 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.213 -0.449 . . . . 73.329999999999998 111.527 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -95.08 -55.4 3.09 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.753 -0.832 . . . . 74.200000000000003 108.753 172.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -65.68 -41.83 91.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.248 0.547 . . . . 73.230000000000004 110.22 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . 0.467 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 3.0 tmm_? -71.21 -13.9 62.07 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.55 -0.75 . . . . 74.140000000000001 110.23 -178.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -90.98 -25.51 19.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.28 -0.418 . . . . 71.519999999999996 110.819 177.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 23.2 p -83.36 -9.19 59.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.102 0.477 . . . . 73.349999999999994 110.517 177.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -100.72 157.55 16.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.871 -0.604 . . . . 74.109999999999999 109.489 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . 0.415 ' HB2' ' HE3' ' B' ' 296' ' ' LYS . 30.4 mtmt . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.227 -0.892 . . . . 74.129999999999995 109.843 -175.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 121.129 0.49 . . . . 73.430000000000007 110.3 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -96.06 1.23 52.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.795 -0.639 . . . . 74.319999999999993 110.356 -177.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -149.56 169.4 21.02 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.964 -0.562 . . . . 73.230000000000004 110.598 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -90.54 -71.84 0.6 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.206 -0.665 . . . . 75.109999999999999 109.206 172.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -129.67 -46.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 62.039999999999999 110.049 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.89 164.45 22.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.937 -0.574 . . . . 72.099999999999994 111.599 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.533 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.4 OUTLIER -80.36 43.17 0.62 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.572 -0.74 . . . . 73.329999999999998 112.009 -175.589 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -44.49 -58.81 2.76 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.103 0.409 . . . . 74.420000000000002 112.103 -173.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.6 -21.64 53.98 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.171 0.804 . . . . 72.439999999999998 113.171 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -75.94 -49.22 18.38 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.338 -0.226 . . . . 72.219999999999999 111.032 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.675 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -71.01 -17.48 62.63 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.729 0.776 . . . . 73.439999999999998 109.933 -174.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.4 m -57.26 -37.41 72.31 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 114.453 -1.249 . . . . 64.230000000000004 111.292 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.518 ' HB2' HD11 ' B' ' 217' ' ' LEU . 27.3 mt-10 -81.27 -21.13 39.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 73.329999999999998 110.276 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.675 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -69.1 -41.99 76.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 73.349999999999994 109.402 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.493 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.0 mt -74.07 -23.48 18.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.963 -0.562 . . . . 60.340000000000003 110.238 175.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 21.2 mmmt -58.67 -41.3 85.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 72.219999999999999 111.335 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.501 HD11 HD12 ' B' ' 214' ' ' LEU . 2.6 tm? -66.8 -31.38 71.97 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.266 -0.642 . . . . 74.219999999999999 109.266 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 -33.23 72.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.43 -0.805 . . . . 74.349999999999994 110.231 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.642 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 95.1 m-20 -61.39 -42.41 98.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.652 -0.704 . . . . 65.019999999999996 110.494 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.44 -27.38 67.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.947 -0.569 . . . . 75.140000000000001 111.461 -177.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -82.65 -30.13 29.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.276 0.56 . . . . 70.239999999999995 109.916 176.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.413 ' ND2' HG21 ' A' ' 29' ' ' THR . 29.2 t-20 -73.8 -20.07 60.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.501 -0.772 . . . . 72.129999999999995 110.356 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.642 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 89.7 mt-30 -64.2 -16.48 62.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.103 -0.498 . . . . 74.540000000000006 111.059 179.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.45 HD21 HG13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -71.88 104.64 3.54 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.556 -0.535 . . . . 70.129999999999995 109.556 177.368 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -65.68 -34.53 78.43 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.46 -0.791 . . . . 72.329999999999998 111.912 -174.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -78.7 -5.78 54.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.325 0.491 . . . . 74.019999999999996 112.325 -176.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.45 HG13 HD21 ' A' ' 24' ' ' ASN . 7.2 mt -106.05 152.14 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.057 0.456 . . . . 71.049999999999997 110.222 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -79.35 155.96 28.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.76 -0.655 . . . . 74.340000000000003 109.68 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.413 HG21 ' ND2' ' A' ' 22' ' ' ASN . 8.1 m -69.84 -23.97 63.38 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.116 0.484 . . . . 72.109999999999999 110.431 -177.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.44 -14.62 74.72 Favored Glycine 0 C--N 1.333 0.396 0 CA-C-N 115.762 -0.654 . . . . 73.319999999999993 113.587 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -71.75 -37.92 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.416 0.608 . . . . 74.5 110.482 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 20.4 t -73.32 -43.03 57.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.598 -0.728 . . . . 74.349999999999994 110.695 -176.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.3 p -62.09 -44.11 97.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.085 0.469 . . . . 74.430000000000007 110.841 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.2 -32.92 74.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.812 -0.631 . . . . 71.010000000000005 111.14 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.7 m -65.89 -38.96 90.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.878 -0.416 . . . . 71.519999999999996 109.878 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . 0.702 ' HB3' HD12 ' B' ' 240' ' ' LEU . 1.2 t80 -67.12 -36.8 82.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.871 -0.604 . . . . 74.340000000000003 109.747 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.587 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.0 tpt -59.47 -53.76 54.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.157 -0.929 . . . . 61.219999999999999 110.473 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TRP . . . . . 0.464 ' NE1' ' HD2' ' A' ' 42' ' ' ARG . 18.1 t-105 -67.7 -38.7 84.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.943 -0.571 . . . . 75.439999999999998 111.42 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.505 ' HB2' HG13 ' B' ' 215' ' ' ILE . . . -62.4 -39.13 92.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.535 -0.302 . . . . 72.129999999999995 111.675 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.472 HD11 ' HB3' ' B' ' 236' ' ' PHE . 47.0 tp -65.44 -31.29 72.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.849 0.357 . . . . 75.530000000000001 110.574 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.18 90.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.248 -0.433 . . . . 74.450000000000003 110.918 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.464 ' HD2' ' NE1' ' A' ' 38' ' ' TRP . 28.8 mtp180 -68.84 -34.0 74.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 65.340000000000003 110.317 -177.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.445 ' HD2' HG22 ' B' ' 215' ' ' ILE . 6.0 t80 -76.64 -32.84 58.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.81 -0.632 . . . . 74.409999999999997 110.896 -175.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -79.21 -33.59 43.68 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.7 -0.227 . . . . 72.140000000000001 111.439 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.32 -17.93 64.97 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.189 0.518 . . . . 63.409999999999997 110.927 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -57.39 -32.32 66.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.193 -0.912 . . . . 74.319999999999993 111.062 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -85.05 1.68 46.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 111.969 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.57 ' C ' ' HE2' ' A' ' 58' ' ' MET . . . -58.59 -38.06 90.47 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.445 -0.883 . . . . 63.5 111.898 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.0 p -70.23 -17.9 63.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.85 0.357 . . . . 74.349999999999994 111.528 -177.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.2 p -92.44 -7.18 48.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 70.040000000000006 110.772 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -75.63 -35.96 60.35 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.229 -0.441 . . . . 52.350000000000001 111.677 -173.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.73 ' HE2' ' HG2' ' A' ' 61' ' ' LYS . 1.0 OUTLIER -147.27 175.67 10.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.329 0.585 . . . . 73.109999999999999 112.349 -175.8 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.619 ' HG3' HG21 ' A' ' 54' ' ' THR . 16.3 pt-20 -89.24 -37.08 15.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.08 -0.964 . . . . 73.030000000000001 111.546 -174.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.619 HG21 ' HG3' ' A' ' 53' ' ' GLU . 65.4 p -118.78 157.69 27.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 75.319999999999993 110.526 -177.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.468 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 21.2 ptmt -66.53 -29.95 70.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 73.540000000000006 110.503 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.34 -49.99 75.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.872 -0.604 . . . . 74.239999999999995 110.384 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.67 ' O ' ' HD3' ' A' ' 61' ' ' LYS . 21.8 mt-30 -78.08 -35.36 49.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.697 -0.683 . . . . 71.319999999999993 110.411 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.57 ' HE2' ' C ' ' A' ' 48' ' ' GLY . 17.0 ttt -61.94 -41.29 97.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.049 0.452 . . . . 74.540000000000006 110.816 178.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.591 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.1 tt0 -65.47 -45.3 84.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.771 -0.65 . . . . 75.030000000000001 111.848 -176.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.36 -24.54 64.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.0 0.428 . . . . 73.430000000000007 111.355 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.73 ' HG2' ' HE2' ' A' ' 52' ' ' PHE . 3.9 mptp? -93.47 8.47 40.5 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 116.033 -0.531 . . . . 75.030000000000001 111.347 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.565 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 17.6 ptpt -51.7 -48.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.507 -0.553 . . . . 70.120000000000005 109.507 177.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.565 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 12.8 tp60 -72.22 -26.03 61.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.103 -0.498 . . . . 72.209999999999994 110.712 -176.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -81.84 -32.8 31.01 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 74.319999999999993 111.495 -176.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.8 ptp -83.36 -26.4 30.53 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 109.051 -0.722 . . . . 61.32 109.051 178.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.668 ' HE3' ' HB3' ' B' ' 277' ' ' LEU . 79.4 mtp -83.86 -4.68 58.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.16 -0.927 . . . . 73.420000000000002 111.756 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.59 -29.28 64.53 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.781 -0.822 . . . . 74.010000000000005 108.781 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.415 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 28.6 m-85 -99.93 -5.99 27.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.653 -1.158 . . . . 75.400000000000006 111.441 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.506 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 19.1 m-30 -77.3 -54.05 6.94 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.685 -1.228 . . . . 72.310000000000002 107.685 169.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.54 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -60.08 -66.27 0.55 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.308 -0.406 . . . . 72.030000000000001 110.21 171.313 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.422 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 10.6 t70 -95.44 82.62 3.7 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.437 0.532 . . . . 72.420000000000002 112.437 -171.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 8.8 mmm180 -153.15 -37.01 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.278 -0.419 . . . . 75.239999999999995 111.53 166.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.79 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -84.74 2.51 41.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 119.804 -0.758 . . . . 72.310000000000002 109.019 178.79 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.868 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 85.1 tttt -60.65 -50.55 73.05 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.039 -0.982 . . . . 73.5 110.079 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -37.19 85.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.255 -0.43 . . . . 75.049999999999997 111.113 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.5 mtt -63.01 -41.44 99.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.416 0.627 . . . . 74.400000000000006 109.919 177.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.565 ' HB3' ' HE1' ' B' ' 266' ' ' MET . 1.3 tt -67.16 -43.06 83.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.815 -1.084 . . . . 73.439999999999998 109.86 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.619 ' HB2' ' HE3' ' B' ' 266' ' ' MET . 8.5 t70 -58.84 -41.17 86.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.279 -0.873 . . . . 65.129999999999995 110.672 178.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.67 -10.36 59.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.413 -0.812 . . . . 70.239999999999995 111.987 -176.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.46 -3.17 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.783 -0.367 . . . . 73.120000000000005 111.463 -179.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.618 ' HE1' ' HA ' ' B' ' 245' ' ' ALA . 23.8 mtt -88.16 -177.77 5.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.287 0.565 . . . . 73.019999999999996 111.752 177.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.713 ' HG2' HD12 ' A' ' 85' ' ' ILE . 34.1 mt-10 66.77 -3.75 0.87 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.634 -1.166 . . . . 71.030000000000001 112.879 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -56.45 -39.39 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.129 0.49 . . . . 71.310000000000002 110.405 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.421 ' HB2' ' HE2' ' B' ' 258' ' ' MET . 33.0 m-85 -92.71 -16.14 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.971 -0.559 . . . . 74.25 110.514 178.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.713 HD12 ' HG2' ' A' ' 82' ' ' GLU . 62.0 mt -79.1 -55.58 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 72.230000000000004 110.808 -175.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.0 pt-20 -64.64 -31.19 72.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.124 0.488 . . . . 55.539999999999999 110.268 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -89.12 7.72 33.66 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.827 -0.624 . . . . 64.230000000000004 111.382 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -62.24 -40.81 97.39 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.072 -0.344 . . . . 75.540000000000006 110.072 178.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -57.26 -41.73 80.19 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.402 -0.592 . . . . 72.349999999999994 109.402 176.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -65.31 -54.33 30.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.142 -0.935 . . . . 72.010000000000005 110.748 177.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.567 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 53.9 m-85 -61.24 -49.43 77.12 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.098 0.407 . . . . 73.030000000000001 112.098 -178.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -60.46 -19.85 57.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.25 0.548 . . . . 74.349999999999994 111.103 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -97.25 -29.36 13.6 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.171 -0.468 . . . . 74.030000000000001 111.156 -178.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 17.4 p -87.53 -4.9 58.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.09 -0.504 . . . . 74.519999999999996 111.071 179.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.567 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 81.5 mt-30 -70.53 136.17 49.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.035 -0.53 . . . . 63.130000000000003 109.801 173.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 115.941 -0.572 . . . . 75.030000000000001 111.494 -170.378 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 C--O 1.234 0.269 0 CA-C-O 120.816 0.341 . . . . 71.109999999999999 110.628 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -95.96 13.81 25.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.535 0.683 . . . . 62.119999999999997 109.771 175.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 203' ' ' ASN . . . . . 0.562 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 3.2 p-10 -133.88 143.42 48.28 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.068 -0.969 . . . . 74.340000000000003 108.57 174.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 204' ' ' GLU . . . . . 0.532 ' H ' ' HD2' ' B' ' 208' ' ' TYR . 38.4 tt0 -85.51 -83.48 0.17 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.848 0.356 . . . . 73.319999999999993 111.092 -178.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -116.18 0.11 12.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.401 0.62 . . . . 73.420000000000002 110.739 -177.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 206' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -143.29 179.9 6.8 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.175 -0.466 . . . . 75.319999999999993 111.629 -174.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 207' ' ' PHE . . . . . 0.414 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.2 OUTLIER -73.51 43.91 0.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.218 -0.901 . . . . 72.010000000000005 112.139 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 208' ' ' TYR . . . . . 0.532 ' HD2' ' H ' ' B' ' 204' ' ' GLU . 59.0 m-85 -60.52 -26.04 66.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.08 0.466 . . . . 75.030000000000001 110.991 -178.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -74.48 -24.04 58.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 72.329999999999998 111.539 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 210' ' ' ARG . . . . . 0.414 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 25.1 mmt180 -89.34 -57.67 2.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.569 -0.287 . . . . 74.340000000000003 111.446 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 211' ' ' ALA . . . . . 0.549 ' HA ' HD22 ' B' ' 214' ' ' LEU . . . -52.55 -26.79 14.21 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.575 0.583 . . . . 60.409999999999997 112.575 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 7.3 t -69.58 -20.72 63.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.553 0.216 . . . . 70.109999999999999 111.024 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . 0.439 ' HB2' HD12 ' A' ' 17' ' ' LEU . 38.9 mt-10 -85.45 -30.56 23.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.065 -0.717 . . . . 75.530000000000001 109.065 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 0.549 HD22 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.01 -50.1 67.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.216 -0.902 . . . . 75.310000000000002 109.962 177.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 215' ' ' ILE . . . . . 0.505 HG13 ' HB2' ' A' ' 39' ' ' ALA . 82.3 mt -65.32 -30.98 51.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.864 -0.607 . . . . 75.310000000000002 110.74 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 216' ' ' LYS . . . . . 0.411 ' HD2' ' O ' ' B' ' 216' ' ' LYS . 0.5 OUTLIER -61.51 -29.8 70.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.892 -0.594 . . . . 72.329999999999998 110.799 -176.762 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.5 tm? -72.01 -41.39 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.493 -0.558 . . . . 73.310000000000002 109.493 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.7 -39.11 79.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.755 -0.657 . . . . 73.239999999999995 111.262 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 219' ' ' ASN . . . . . 0.644 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.1 m-20 -61.89 -34.19 75.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 75.150000000000006 111.31 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -65.64 -34.26 77.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.918 0.389 . . . . 74.540000000000006 111.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -79.67 -26.7 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.139 0.495 . . . . 74.230000000000004 110.406 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -79.27 -9.65 59.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.621 -0.718 . . . . 74.209999999999994 110.417 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 223' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 87.2 mm-40 -73.95 -10.58 59.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.323 -0.399 . . . . 62.439999999999998 110.79 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 224' ' ' ASN . . . . . 0.742 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 3.7 t30 -70.68 112.34 6.84 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.833 -0.803 . . . . 63.009999999999998 108.833 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.7 t -47.85 -38.44 16.12 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 114.461 1.282 . . . . 71.530000000000001 114.461 -170.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -99.06 14.99 27.28 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.369 0.877 . . . . 75.030000000000001 113.369 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 227' ' ' ILE . . . . . 0.742 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 8.1 mm -96.7 154.21 3.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 O-C-N 121.472 -0.767 . . . . 63.5 110.062 177.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 228' ' ' GLN . . . . . 0.758 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 9.2 mt-30 -91.87 138.76 31.29 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.467 -0.938 . . . . 74.019999999999996 108.467 171.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 36.6 m -58.0 -27.63 63.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.151 0.5 . . . . 64.540000000000006 110.26 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -72.38 -11.6 76.22 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.512 -0.767 . . . . 74.219999999999999 113.631 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 231' ' ' GLU . . . . . 0.758 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 32.4 mt-10 -85.61 -27.54 25.39 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 117.886 0.843 . . . . 75.430000000000007 109.489 178.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.3 t -79.03 -39.48 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.356 -0.838 . . . . 70.340000000000003 110.175 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.6 p -61.08 -42.02 97.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.109 -0.496 . . . . 54.030000000000001 110.601 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.06 74.86 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.804 -0.635 . . . . 75.420000000000002 110.989 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 235' ' ' SER . . . . . 0.533 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 34.1 m -66.32 -37.45 85.41 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.867 0.365 . . . . 74.439999999999998 110.122 178.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 236' ' ' PHE . . . . . 0.651 ' CD1' HD12 ' A' ' 14' ' ' LEU . 9.6 t80 -64.6 -37.55 87.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.311 0.577 . . . . 73.340000000000003 109.463 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 237' ' ' MET . . . . . 0.79 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.4 ttm -66.39 -48.57 69.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.519 -0.764 . . . . 74.439999999999998 111.349 177.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 238' ' ' TRP . . . . . 0.469 ' O ' ' HG3' ' B' ' 242' ' ' ARG . 28.0 t-105 -62.14 -41.38 98.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.784 0.326 . . . . 75.430000000000007 110.981 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 239' ' ' ALA . . . . . 0.649 ' HB3' ' HB3' ' A' ' 11' ' ' ALA . . . -63.18 -39.29 94.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.84 0.353 . . . . 71.219999999999999 111.068 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 240' ' ' LEU . . . . . 0.702 HD12 ' HB3' ' A' ' 36' ' ' PHE . 42.5 tp -65.8 -36.12 82.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 73.109999999999999 110.503 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 241' ' ' ALA . . . . . 0.422 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.1 -40.26 95.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.005 -0.543 . . . . 74.340000000000003 110.958 179.135 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 242' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' B' ' 238' ' ' TRP . 44.5 mtp180 -72.09 -37.27 69.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.221 -0.445 . . . . 71.319999999999993 110.073 -178.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -70.78 -40.93 72.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.803 -0.635 . . . . 71.230000000000004 111.013 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -69.28 -28.12 66.02 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.93 0.344 . . . . 64.420000000000002 111.93 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 245' ' ' ALA . . . . . 0.618 ' HA ' ' HE1' ' A' ' 81' ' ' MET . . . -68.82 -18.65 64.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.022 0.439 . . . . 73.450000000000003 111.324 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.8 t90 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.585 -0.734 . . . . 73.420000000000002 111.13 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -72.73 -5.77 40.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 65.340000000000003 112.457 -171.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 248' ' ' GLY . . . . . 0.536 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -58.88 -27.77 62.42 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.469 -0.872 . . . . 40.25 111.502 175.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 249' ' ' SER . . . . . 0.452 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 27.8 p -67.56 -21.2 65.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.558 -0.321 . . . . 75.140000000000001 111.426 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 26.5 p -91.12 -12.13 36.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.06 0.457 . . . . 74.439999999999998 111.039 -176.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 26.1 t -67.07 -42.53 84.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.659 . . . . 72.530000000000001 111.748 -172.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 252' ' ' PHE . . . . . 0.539 ' HD2' ' HG3' ' B' ' 261' ' ' LYS . 1.3 m-85 -150.61 -178.59 6.64 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.985 0.735 . . . . 74.120000000000005 112.985 -173.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 253' ' ' GLU . . . . . 0.504 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.5 pt-20 -93.13 -53.05 4.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.685 -1.143 . . . . 74.049999999999997 110.753 -176.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 254' ' ' THR . . . . . 0.504 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.0 p -100.84 158.57 15.88 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.086 -0.506 . . . . 73.209999999999994 110.505 -178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -68.36 -31.25 70.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.425 -0.352 . . . . 73.310000000000002 111.306 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.46 -45.51 93.44 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 64.420000000000002 110.673 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 257' ' ' GLN . . . . . 0.53 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 18.4 mt-30 -80.49 -35.69 34.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 65.120000000000005 110.129 -179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 258' ' ' MET . . . . . 0.452 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.4 ttt -63.81 -44.89 91.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.512 -0.767 . . . . 72.049999999999997 111.447 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 259' ' ' GLN . . . . . 0.535 ' HA ' HD11 ' A' ' 85' ' ' ILE . 34.6 tt0 -61.3 -39.46 90.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.045 -0.525 . . . . 74.510000000000005 111.39 -178.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.68 63.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.158 -0.474 . . . . 74.239999999999995 111.328 -177.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 261' ' ' LYS . . . . . 0.539 ' HG3' ' HD2' ' B' ' 252' ' ' PHE . 31.9 mmmt -97.51 -5.82 35.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.204 -0.453 . . . . 72.349999999999994 110.897 -176.579 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 262' ' ' LYS . . . . . 0.457 ' HA ' ' HE2' ' B' ' 265' ' ' MET . 32.7 ttpt -52.67 -54.18 36.95 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.011 0.434 . . . . 71.299999999999997 110.477 -178.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -68.02 -33.05 73.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.091 -0.504 . . . . 72.209999999999994 110.561 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.21 -40.38 78.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.72 -0.673 . . . . 74.239999999999995 111.763 -176.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 265' ' ' MET . . . . . 0.536 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 21.1 ptp -79.82 -25.61 40.77 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.488 0.661 . . . . 73.049999999999997 109.459 -177.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 266' ' ' MET . . . . . 0.619 ' HE3' ' HB2' ' A' ' 78' ' ' ASP . 44.5 mtp -78.32 -42.62 30.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.168 -0.924 . . . . 63.439999999999998 112.681 -176.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.61 -27.34 69.17 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.065 0.394 . . . . 71.409999999999997 112.065 -162.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 268' ' ' TYR . . . . . 0.581 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 30.2 p90 -94.15 -8.12 40.37 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.277 -0.569 . . . . 74.239999999999995 111.133 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 269' ' ' TYR . . . . . 0.409 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.5 m-30 -62.38 -49.69 74.54 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 110.004 -0.369 . . . . 74.439999999999998 110.004 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 270' ' ' MET . . . . . 0.868 ' HE2' ' HA ' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -53.54 -41.19 66.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.749 0.785 . . . . 73.219999999999999 109.427 175.314 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -86.75 8.85 20.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.516 -1.22 . . . . 74.329999999999998 111.66 -172.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 272' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 6.0 mmm-85 -84.09 -42.44 16.09 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 121.588 -0.695 . . . . 74.109999999999999 110.159 -174.245 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 273' ' ' TYR . . . . . 0.587 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.0 OUTLIER -99.61 14.94 28.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.698 -0.683 . . . . 75.239999999999995 110.318 -178.653 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -58.45 -58.67 7.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 75.409999999999997 109.64 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.2 -35.38 80.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.162 -0.927 . . . . 74.120000000000005 110.879 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.8 mtt -62.45 -42.43 99.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.857 -0.61 . . . . 71.540000000000006 110.285 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 277' ' ' LEU . . . . . 0.668 ' HB3' ' HE3' ' A' ' 66' ' ' MET . 1.6 tt -70.73 -38.9 73.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.208 -0.906 . . . . 74.239999999999995 110.088 -176.325 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -61.72 -35.37 77.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 74.530000000000001 110.048 175.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.54 -13.01 60.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.577 -0.738 . . . . 73.439999999999998 111.271 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -99.69 -9.25 23.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.571 0.701 . . . . 64.329999999999998 109.351 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 281' ' ' MET . . . . . 0.418 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.2 mmt -84.14 -170.07 2.9 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.85 -1.068 . . . . 73.519999999999996 109.786 174.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 282' ' ' GLU . . . . . 0.611 ' HA ' HD11 ' B' ' 285' ' ' ILE . 22.8 mt-10 72.09 -31.68 0.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.248 -0.887 . . . . 75.430000000000007 113.243 169.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -54.62 -54.79 36.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 74.340000000000003 110.954 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . 0.489 ' HB2' ' HE1' ' A' ' 58' ' ' MET . 75.8 m-85 -68.4 -25.8 65.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.948 -0.569 . . . . 73.129999999999995 110.43 178.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 285' ' ' ILE . . . . . 0.611 HD11 ' HA ' ' B' ' 282' ' ' GLU . 54.6 mt -71.21 -56.24 11.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.18 -0.464 . . . . 60.210000000000001 110.76 -178.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 286' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -65.37 -27.91 68.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.063 0.458 . . . . 74.109999999999999 110.882 -178.001 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -94.53 10.3 35.18 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.431 -0.35 . . . . 72.340000000000003 111.497 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 288' ' ' PHE . . . . . 0.468 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 58.7 t80 -59.78 -48.81 80.2 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.18 -0.304 . . . . 74.409999999999997 110.18 177.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.42 -16.97 64.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.331 -0.395 . . . . 72.349999999999994 110.936 177.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -82.1 -53.82 5.78 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.357 -0.608 . . . . 74.150000000000006 109.357 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 291' ' ' TYR . . . . . 0.641 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 62.1 m-85 -64.62 -48.58 74.37 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.072 -0.513 . . . . 75.129999999999995 111.358 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -61.03 -14.89 26.47 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.97 0.414 . . . . 75.319999999999993 110.979 -177.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -98.81 -16.2 18.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.273 -0.421 . . . . 72.519999999999996 111.381 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 21.0 p -119.02 8.5 11.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.171 0.51 . . . . 75.109999999999999 111.21 -176.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 295' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 69.2 mt-30 -65.8 153.97 40.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.471 -0.786 . . . . 72.340000000000003 111.882 -177.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt . . . . . 0 C--N 1.316 -0.853 0 CA-C-N 114.689 -1.141 . . . . 72.150000000000006 109.288 179.258 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 N--CA 1.451 -0.4 0 N-CA-C 108.436 -0.95 . . . . 65.239999999999995 108.436 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -82.3 -81.17 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.519 -0.472 . . . . 72.200000000000003 110.65 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -120.4 -11.47 9.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.134 0.492 . . . . 74.239999999999995 110.977 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . . . -108.68 169.52 8.61 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.94 -0.573 . . . . 44.119999999999997 111.547 -177.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.81 41.98 0.76 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.614 -0.721 . . . . 75.310000000000002 111.737 -176.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 6' ' ' ALA . 75.3 m-85 -50.35 -49.91 52.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.388 -0.369 . . . . 74.439999999999998 111.645 -176.245 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.11 88.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.921 -0.581 . . . . 61.420000000000002 111.819 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtm105 -72.46 -51.04 21.92 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.961 -0.296 . . . . 74.420000000000002 111.618 -176.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.627 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -60.5 -24.72 65.53 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.631 0.729 . . . . 61.340000000000003 110.796 -178.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -28.5 68.18 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.062 -0.972 . . . . 75.299999999999997 111.468 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.439 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.8 mt-10 -74.87 -29.21 60.95 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.37 0.605 . . . . 71.239999999999995 109.47 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -61.24 -45.94 92.47 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.872 -1.058 . . . . 64.239999999999995 109.694 177.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 65.1 mt -71.96 -27.06 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.713 -0.676 . . . . 71.409999999999997 110.276 177.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -31.94 73.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.063 -0.517 . . . . 61.109999999999999 110.431 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.583 HD12 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -68.34 -40.12 81.68 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.15 -0.685 . . . . 71.319999999999993 109.15 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.77 75.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 72.5 111.054 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.556 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 11.5 m-80 -58.52 -40.78 83.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 74.25 110.785 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -67.12 -34.83 78.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.85 -0.614 . . . . 73.329999999999998 111.655 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -76.93 -28.01 55.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.902 0.382 . . . . 75.219999999999999 110.675 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.45 ' HB2' HG21 ' A' ' 32' ' ' VAL . 65.9 t30 -83.81 -6.32 59.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 55.420000000000002 110.794 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 46.2 mt-30 -69.97 -11.2 60.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.388 -0.369 . . . . 75.099999999999994 111.861 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.735 ' HB3' ' CG1' ' A' ' 27' ' ' ILE . 2.8 t-20 -80.3 135.53 36.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.819 -0.437 . . . . 73.420000000000002 109.819 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -70.14 -40.58 74.71 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 113.197 0.814 . . . . 63.229999999999997 113.197 -170.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -87.43 1.33 53.72 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.433 0.531 . . . . 72.420000000000002 112.433 -174.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.735 ' CG1' ' HB3' ' A' ' 24' ' ' ASN . 13.2 mm -86.88 147.78 5.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.178 0.514 . . . . 61.210000000000001 109.658 178.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.763 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 2.2 mp0 -82.65 140.8 32.94 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.838 -0.801 . . . . 74.420000000000002 108.838 174.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.2 m -59.35 -28.18 66.6 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.147 -0.686 . . . . 73.209999999999994 109.147 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.526 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -74.09 -12.48 81.47 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.903 -1.044 . . . . 53.310000000000002 113.399 177.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.763 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 43.5 mt-10 -78.63 -35.56 45.33 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 118.079 0.94 . . . . 74.340000000000003 109.92 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.45 HG21 ' HB2' ' A' ' 22' ' ' ASN . 21.7 t -74.22 -40.86 51.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.732 -0.667 . . . . 72.420000000000002 110.605 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 p -61.52 -44.14 97.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.063 0.458 . . . . 64.319999999999993 110.255 176.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.43 -31.03 71.91 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.659 -0.701 . . . . 73.219999999999999 110.982 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 63.4 m -67.89 -42.46 81.17 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.029 -0.36 . . . . 73.340000000000003 110.029 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.602 ' CD1' HD12 ' B' ' 214' ' ' LEU . 4.0 t80 -64.61 -33.72 76.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.698 0.761 . . . . 74.409999999999997 109.093 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.658 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.1 tpt -62.23 -60.08 4.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.646 -1.161 . . . . 64.209999999999994 110.935 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.445 ' CZ2' ' HD3' ' A' ' 42' ' ' ARG . 25.7 t-105 -59.36 -33.89 71.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.354 -0.839 . . . . 65.519999999999996 111.303 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.482 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.34 -42.99 95.97 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.232 -0.44 . . . . 55.340000000000003 110.991 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.588 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.3 tp -68.83 -34.09 74.91 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 110.024 -0.361 . . . . 64.019999999999996 110.024 178.18 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -33.11 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 61.509999999999998 111.107 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.485 ' HG2' ' ND2' ' B' ' 280' ' ' ASN . 28.5 mtm180 -87.27 -45.59 10.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.387 -0.369 . . . . 64.420000000000002 111.061 178.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.517 ' HD2' HG23 ' B' ' 215' ' ' ILE . 18.5 t80 -68.18 -33.2 74.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.132 -0.485 . . . . 73.400000000000006 111.458 -173.613 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -86.49 -22.96 26.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.726 0.298 . . . . 73.310000000000002 111.6 -173.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.25 -10.4 59.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.45 0.643 . . . . 62.219999999999999 110.656 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -59.74 -24.9 64.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.014 -0.994 . . . . 72.049999999999997 111.57 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.403 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 75.3 m-85 -86.65 -0.53 56.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.039 0.385 . . . . 60.25 112.039 -176.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.12 -29.68 75.95 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 119.982 -1.104 . . . . 41.420000000000002 110.751 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.6 m -71.57 -5.45 33.41 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.254 -0.473 . . . . 64.450000000000003 111.825 -176.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -119.24 14.84 13.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.982 0.42 . . . . 71.230000000000004 111.15 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.95 -47.76 11.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 75.420000000000002 110.476 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.621 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 12.8 m-85 -142.47 165.07 28.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 116.121 -0.49 . . . . 65.239999999999995 110.145 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.428 ' HG2' ' N ' ' A' ' 54' ' ' THR . 1.6 pm0 -82.12 -41.77 20.03 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.136 -0.938 . . . . 64.140000000000001 111.362 -171.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.428 ' N ' ' HG2' ' A' ' 53' ' ' GLU . 65.4 p -100.92 149.16 24.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.99 -0.55 . . . . 75.450000000000003 109.739 178.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.504 ' HB2' HG23 ' B' ' 285' ' ' ILE . 13.2 pttm -68.07 -25.13 65.2 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.57 -0.53 . . . . 72.140000000000001 109.57 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -60.49 -49.77 76.22 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.536 -0.756 . . . . 52.100000000000001 110.574 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.54 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 98.0 mt-30 -81.08 -24.69 37.6 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.291 -0.413 . . . . 65.420000000000002 110.341 -178.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.497 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 11.7 ttt -71.8 -44.47 63.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.604 -0.725 . . . . 74.230000000000004 111.194 178.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 35.4 tt0 -62.68 -36.32 82.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 74.120000000000005 111.371 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.01 -15.03 63.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.152 0.501 . . . . 73.430000000000007 111.313 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.621 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 32.0 mmmt -99.13 1.58 45.17 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.178 -0.465 . . . . 73.319999999999993 111.054 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 0.2 OUTLIER -52.37 -48.52 65.53 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.457 0.473 . . . . 70.409999999999997 110.469 -176.465 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.596 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 5.4 tp-100 -72.3 -28.74 63.28 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.223 -0.444 . . . . 75.219999999999999 110.588 -175.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -78.17 -37.06 46.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.852 -0.613 . . . . 61.420000000000002 111.378 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 21.7 ptp -79.71 -26.12 40.95 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.092 -0.707 . . . . 62.109999999999999 109.092 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.53 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 88.7 mtp -81.23 -13.22 58.75 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.398 -0.819 . . . . 60.149999999999999 111.53 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -65.33 -26.96 68.27 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 122.115 0.96 . . . . 70.230000000000004 108.793 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -102.78 16.0 27.75 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.113 -1.403 . . . . 74.540000000000006 111.564 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.53 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.7 m-30 -106.83 -45.74 4.12 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.985 -0.746 . . . . 74.420000000000002 108.985 172.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -65.38 -60.66 2.73 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.983 0.421 . . . . 72.239999999999995 110.876 174.604 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -73.84 -16.6 61.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.34 1.237 . . . . 72.409999999999997 114.34 -168.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -96.92 3.04 52.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 113.641 0.978 . . . . 73.540000000000006 113.641 -158.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.582 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 7.42 11.51 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.652 -0.704 . . . . 72.209999999999994 109.203 167.623 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.439 ' O ' ' HE1' ' B' ' 266' ' ' MET . 2.6 pttm -78.78 -39.13 36.72 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.594 -0.73 . . . . 45.310000000000002 111.41 -172.135 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.544 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -70.23 -31.18 68.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.101 0.476 . . . . 70.329999999999998 110.04 -179.735 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.6 mtm -77.04 -27.97 54.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.68 -0.691 . . . . 62.030000000000001 110.038 176.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 6.8 tt -70.51 -46.86 62.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 61.450000000000003 109.778 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.436 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -60.34 -32.23 71.05 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.054 -0.521 . . . . 70.5 110.765 176.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.6 -15.31 62.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.919 -0.582 . . . . 64.409999999999997 111.48 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -104.9 -10.26 17.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.812 0.339 . . . . 75.209999999999994 110.537 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.44 ' O ' HG13 ' A' ' 85' ' ' ILE . 17.0 mmt -68.97 -48.36 63.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 74.150000000000006 110.511 177.447 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 24.0 mm-40 -56.54 -30.28 62.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.686 -0.688 . . . . 73.200000000000003 111.743 -177.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -56.03 -25.76 46.04 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.039 0.447 . . . . 74.209999999999994 110.975 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -107.69 -32.25 7.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.17 -0.468 . . . . 74.329999999999998 110.879 177.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 81' ' ' MET . 62.7 mt -70.61 -63.65 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 111.932 0.345 . . . . 70.519999999999996 111.932 -176.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.728 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 0.9 OUTLIER -76.81 -3.26 37.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.045 0.45 . . . . 70.219999999999999 111.268 -174.525 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -107.98 3.85 24.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.688 -0.687 . . . . 52.299999999999997 110.448 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -52.55 -52.84 52.95 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.293 -0.412 . . . . 74.400000000000006 110.936 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.118 -0.492 . . . . 55.119999999999997 110.753 -177.94 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.439 -0.578 . . . . 64.019999999999996 109.439 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -81.45 -90.58 0.07 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.899 0.381 . . . . 60.140000000000001 110.894 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -106.11 -26.14 11.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 54.140000000000001 110.679 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.434 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -100.23 162.35 13.02 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.117 -0.492 . . . . 71.109999999999999 111.161 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -75.9 43.83 0.28 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.42 -0.809 . . . . 72.099999999999994 112.602 -176.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' B' ' 206' ' ' ALA . 70.9 m-85 -54.17 -41.64 68.74 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.837 0.351 . . . . 73.129999999999995 111.321 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.7 -19.8 63.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.837 -0.62 . . . . 63.409999999999997 112.035 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.412 HH12 HD12 ' A' ' 27' ' ' ILE . 49.2 mtm180 -92.9 -56.97 2.79 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.943 -0.303 . . . . 75.230000000000004 110.799 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.715 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -51.51 -27.37 10.47 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.539 0.57 . . . . 52.520000000000003 112.539 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.6 t -69.5 -20.95 63.71 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 121.058 -0.257 . . . . 60.43 111.363 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.406 ' HB2' HD11 ' A' ' 17' ' ' LEU . 49.8 mt-10 -81.12 -29.46 34.82 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.254 -0.647 . . . . 70.5 109.254 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.715 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.0 mm? -63.64 -46.54 85.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.975 -1.011 . . . . 72.030000000000001 108.96 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.517 HG23 ' HD2' ' A' ' 43' ' ' TYR . 74.6 mt -67.59 -32.66 57.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.404 -0.816 . . . . 73.540000000000006 110.253 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 2.1 tmmt? -60.39 -36.86 79.09 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.64 -0.709 . . . . 75.310000000000002 111.167 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.528 HD12 HD13 ' A' ' 14' ' ' LEU . 3.2 tm? -63.27 -41.18 99.0 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.787 -0.82 . . . . 72.430000000000007 108.787 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.11 -28.99 68.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 53.340000000000003 110.849 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 5.8 m-20 -64.35 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 65.430000000000007 111.036 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -66.82 -39.95 87.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 62.409999999999997 111.196 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.84 -22.2 53.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.446 0.641 . . . . 75.019999999999996 109.945 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -81.34 -3.31 52.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.167 -0.924 . . . . 61.520000000000003 110.419 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 52.0 mt-30 -78.93 -8.18 58.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.421 -0.354 . . . . 52.340000000000003 110.864 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.84 105.21 12.78 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.646 -0.501 . . . . 72.310000000000002 109.646 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.6 t -59.43 -32.34 70.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.305 0.854 . . . . 75.340000000000003 113.305 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -79.01 -12.4 60.03 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.795 -0.362 . . . . 74.109999999999999 111.068 -175.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 10.0 mt -97.82 150.0 4.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.104 0.478 . . . . 63.210000000000001 109.966 -177.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -85.87 150.7 24.34 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.814 -0.63 . . . . 71.209999999999994 109.752 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.3 m -57.53 -23.92 53.08 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.674 -0.694 . . . . 73.409999999999997 110.277 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 230' ' ' GLY . . . . . 0.403 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.96 -25.62 75.44 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.348 -0.842 . . . . 55.039999999999999 113.692 -179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -76.64 -13.58 60.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 117.876 0.838 . . . . 73.340000000000003 110.392 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 12.6 t -90.96 -42.06 13.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.705 -0.68 . . . . 50.240000000000002 109.858 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 25.2 p -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.112 -0.494 . . . . 74.349999999999994 110.642 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.65 -33.1 74.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.124 -0.489 . . . . 60.140000000000001 110.693 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 38.7 m -67.68 -40.76 84.4 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.921 -0.4 . . . . 73.140000000000001 109.921 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.625 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.9 t80 -63.07 -35.63 80.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.539 0.685 . . . . 75.519999999999996 109.478 176.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.588 ' SD ' HD21 ' A' ' 40' ' ' LEU . 8.4 tpt -59.45 -60.74 3.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.796 -1.093 . . . . 75.230000000000004 110.808 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.403 ' CZ2' ' HD3' ' B' ' 242' ' ' ARG . 25.3 t-105 -59.56 -36.26 75.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.228 -0.896 . . . . 74.540000000000006 111.532 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -64.41 -44.4 91.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.394 -0.366 . . . . 73.219999999999999 111.411 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.658 HD21 ' SD ' ' A' ' 37' ' ' MET . 43.5 tp -65.69 -33.94 77.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.4 . . . . 75.319999999999993 110.658 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.538 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.81 -43.6 97.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.95 -0.568 . . . . 32.240000000000002 110.924 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 242' ' ' ARG . . . . . 0.403 ' HD3' ' CZ2' ' B' ' 238' ' ' TRP . 68.6 mtm180 -70.95 -36.09 72.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 62.140000000000001 110.988 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -72.77 -39.17 66.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.336 -0.393 . . . . 65.329999999999998 110.725 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -72.69 -32.08 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.395 -0.366 . . . . 54.439999999999998 111.98 -177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -67.45 -14.74 63.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.971 0.415 . . . . 72.230000000000004 111.371 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 80.2 t90 -60.56 -38.68 85.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.052 -0.522 . . . . 61.399999999999999 110.962 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.526 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 62.0 m-85 -68.6 -13.92 62.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.288 0.477 . . . . 74.319999999999993 112.288 -175.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -61.44 -33.81 86.05 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.419 -0.896 . . . . 35.530000000000001 111.767 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 249' ' ' SER . . . . . 0.626 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 70.1 p -65.92 -23.75 66.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.807 0.336 . . . . 71.099999999999994 111.756 -176.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 14.5 t -108.83 22.19 16.24 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.227 0.537 . . . . 75.140000000000001 110.444 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.4 t -87.13 -55.32 3.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.175 -0.466 . . . . 64.209999999999994 110.939 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.624 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -130.03 -179.65 5.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.083 0.468 . . . . 74.540000000000006 111.842 -177.313 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.417 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.2 pt-20 -89.87 -41.85 11.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.238 -0.892 . . . . 75.340000000000003 111.539 -173.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.417 HG23 ' HG3' ' B' ' 253' ' ' GLU . 81.9 p -117.31 151.92 35.97 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 110.026 -0.361 . . . . 75.25 110.026 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.728 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 12.7 ptmm? -65.77 -25.8 67.42 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.373 0.421 . . . . 70.219999999999999 110.441 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -56.19 -54.58 43.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 73.329999999999998 110.217 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.643 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 85.8 mt-30 -79.43 -36.3 39.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.582 -0.735 . . . . 71.140000000000001 110.03 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.626 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 12.0 ttt -59.93 -46.79 88.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.488 -0.778 . . . . 62.119999999999997 111.577 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 33.5 tt0 -65.3 -30.27 71.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.953 0.406 . . . . 71.030000000000001 110.96 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -77.55 -9.94 59.21 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.17 -0.468 . . . . 64.209999999999994 110.897 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.643 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.8 mmmt -104.14 -1.13 27.72 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 116.263 -0.426 . . . . 61.399999999999999 110.693 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' B' ' 259' ' ' GLN . 17.1 ptpt -57.5 -45.51 84.84 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.39 -0.368 . . . . 55.450000000000003 110.963 -174.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.507 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 5.1 tp-100 -73.4 -19.56 60.96 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.058 -0.257 . . . . 75.209999999999994 110.924 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -83.26 -33.95 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 74.209999999999994 110.908 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' B' ' 262' ' ' LYS . 22.6 ptp -79.93 -26.99 39.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.962 -1.125 . . . . 72.049999999999997 107.962 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.45 ' HG2' HD22 ' A' ' 77' ' ' LEU . 73.1 mtp -89.92 23.86 2.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.55 -1.205 . . . . 73.420000000000002 110.168 174.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -104.28 -29.43 10.79 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.13 -1.063 . . . . 65.439999999999998 108.13 167.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.419 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.6 m-85 -98.21 9.24 43.43 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.685 -1.143 . . . . 61.100000000000001 112.039 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -94.71 -68.19 0.81 Allowed 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.543 -1.28 . . . . 74.140000000000001 107.543 166.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -51.3 -61.29 2.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.134 -0.939 . . . . 73.299999999999997 110.756 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -85.15 19.4 2.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.288 -0.869 . . . . 70.340000000000003 112.483 -166.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.419 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 17.6 mmm180 -121.72 -30.7 4.11 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 121.346 -0.846 . . . . 72.439999999999998 112.564 -175.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.47 ' HE2' ' HG ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -83.75 1.37 43.11 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.533 -1.284 . . . . 64.140000000000001 107.533 172.14 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.476 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 73.5 tttt -58.76 -58.26 9.37 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 112.929 -1.941 . . . . 71.420000000000002 111.279 178.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -32.51 74.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.445 . . . . 63.350000000000001 111.284 -176.028 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 39.1 mtm -78.59 -21.97 47.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.203 0.525 . . . . 64.230000000000004 110.08 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.448 HD22 ' HG2' ' A' ' 66' ' ' MET . 5.6 tt -76.43 -47.14 24.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.665 -0.698 . . . . 62.009999999999998 110.004 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 278' ' ' ASP . . . . . 0.405 ' HB2' ' HE1' ' A' ' 66' ' ' MET . 36.1 t70 -67.15 -26.21 66.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.208 0.528 . . . . 63.539999999999999 110.416 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.01 66.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.603 -0.726 . . . . 71.439999999999998 110.777 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 280' ' ' ASN . . . . . 0.485 ' ND2' ' HG2' ' A' ' 42' ' ' ARG . 35.7 m-80 -89.17 -30.04 18.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.305 -0.407 . . . . 63.240000000000002 110.244 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.623 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -56.08 -58.77 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 75.140000000000001 110.184 176.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 14.9 mm-40 -51.71 -37.33 50.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.612 -0.722 . . . . 75.450000000000003 112.081 -178.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.27 -52.37 65.6 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.255 0.347 . . . . 55.399999999999999 110.65 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -70.42 -38.29 74.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.399 -0.364 . . . . 64.420000000000002 110.941 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.623 HG13 ' O ' ' B' ' 281' ' ' MET . 61.3 mt -59.9 -59.61 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 73.409999999999997 111.312 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 5.9 pt-20 -60.0 -29.72 68.66 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.906 0.384 . . . . 65.109999999999999 111.204 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -90.86 9.44 30.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.423 -0.353 . . . . 72.430000000000007 111.602 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.46 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 39.1 t80 -60.49 -45.33 94.16 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.805 -0.443 . . . . 75.319999999999993 109.805 173.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 . . . . . 0 N--CA 1.465 0.324 0 CA-C-N 115.929 -0.578 . . . . 74.140000000000001 110.616 176.585 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 6' ' ' ALA . 83.9 m-20 . . . . . 0 N--CA 1.452 -0.331 0 N-CA-C 109.222 -0.658 . . . . 71.010000000000005 109.222 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -55.07 -73.09 0.06 Allowed 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.341 0.401 . . . . 65.109999999999999 111.402 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -133.22 -17.34 2.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.15 0.5 . . . . 74.209999999999994 110.694 177.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -107.48 163.27 13.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.96 -0.564 . . . . 51.420000000000002 111.674 -175.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.498 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.18 47.57 1.15 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.151 -0.931 . . . . 70.129999999999995 110.428 176.059 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 6' ' ' ALA . 73.2 m-85 -45.32 -52.09 10.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.032 -0.531 . . . . 74.450000000000003 111.492 -175.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.1 -34.93 74.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 55.520000000000003 111.972 -175.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -65.25 -54.05 35.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.374 -0.375 . . . . 74.409999999999997 110.497 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.69 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -74.19 -11.6 60.34 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.823 0.82 . . . . 65.25 110.265 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -70.23 -28.15 65.03 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.522 -1.217 . . . . 64.140000000000001 110.292 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.454 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.3 mm-40 -82.66 -27.3 31.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.48 0.657 . . . . 73.450000000000003 109.758 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -65.23 -49.89 67.94 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.081 -0.963 . . . . 64.530000000000001 109.446 176.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.505 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.1 mt -65.15 -30.17 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.796 -0.638 . . . . 74.129999999999995 110.201 175.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.721 ' HD3' HE22 ' A' ' 20' ' ' GLN . 5.3 tmtt? -57.98 -45.87 86.07 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.477 -0.783 . . . . 74.040000000000006 110.504 -179.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.465 HD12 HD13 ' B' ' 214' ' ' LEU . 1.8 tm? -56.04 -45.33 79.23 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.675 -0.491 . . . . 52.200000000000003 109.675 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.64 -28.43 65.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.688 -0.687 . . . . 63.549999999999997 111.287 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.626 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 23.4 m-80 -69.53 -26.89 64.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 71.219999999999999 111.374 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.721 HE22 ' HD3' ' A' ' 16' ' ' LYS . 2.6 mp0 -76.12 -30.54 58.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.246 0.546 . . . . 74.329999999999998 110.383 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -86.81 -16.98 34.57 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.89 -0.595 . . . . 64.239999999999995 110.007 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -84.57 -2.99 58.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.769 -0.65 . . . . 52.329999999999998 109.549 173.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 93.6 mt-30 -79.2 -2.16 39.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.807 -0.633 . . . . 74.030000000000001 109.718 173.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.594 HD22 HG13 ' A' ' 27' ' ' ILE . 2.3 t30 -74.84 106.85 6.57 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.1 -1.074 . . . . 54.0 108.1 172.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.2 t -53.53 -40.6 65.63 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 113.825 1.046 . . . . 62.229999999999997 113.825 -167.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -78.91 -21.01 47.98 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 112.36 0.504 . . . . 74.230000000000004 112.36 -176.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.594 HG13 HD22 ' A' ' 24' ' ' ASN . 11.1 mt -84.87 144.57 9.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.171 0.51 . . . . 74.519999999999996 110.139 -176.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.563 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -86.4 156.39 20.19 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.68 -0.691 . . . . 63.299999999999997 109.183 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.1 m -60.62 -30.55 69.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.292 0.567 . . . . 74.010000000000005 109.785 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.477 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -81.95 1.9 85.25 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.326 -0.852 . . . . 23.239999999999998 113.589 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.563 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 21.6 mm-40 -97.33 -19.46 18.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.85 0.825 . . . . 63.439999999999998 109.733 175.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.6 t -81.46 -25.92 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.739 -0.664 . . . . 72.120000000000005 110.169 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 p -59.9 -32.86 71.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.654 -0.703 . . . . 60.119999999999997 111.153 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.27 -34.3 75.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.187 -0.461 . . . . 52.219999999999999 110.71 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 m -69.26 -37.53 77.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 74.129999999999995 109.896 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.577 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 6.7 t80 -68.95 -35.16 76.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.743 -0.662 . . . . 73.019999999999996 109.644 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.765 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 3.9 ttm -70.7 -46.68 62.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.74 -0.664 . . . . 51.43 111.455 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -60.1 -39.57 86.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.108 0.48 . . . . 74.140000000000001 110.331 176.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.58 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.24 -39.7 93.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.895 -0.593 . . . . 74.120000000000005 111.115 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.769 HD21 ' SD ' ' B' ' 237' ' ' MET . 44.0 tp -65.04 -34.8 79.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.363 . . . . 71.140000000000001 110.475 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.99 -48.4 82.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.485 . . . . 65.340000000000003 110.75 177.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' OD1' ' B' ' 280' ' ' ASN . 20.7 mtm180 -68.81 -23.4 64.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 70.140000000000001 111.051 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.458 ' HD2' HG23 ' B' ' 215' ' ' ILE . 15.3 t80 -83.7 -31.35 26.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 72.420000000000002 110.735 -178.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -79.42 -26.01 41.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.786 0.326 . . . . 55.409999999999997 111.179 179.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB2' HD23 ' B' ' 277' ' ' LEU . . . -87.55 13.07 10.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.351 0.596 . . . . 42.439999999999998 110.784 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -76.81 -13.86 59.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.485 -0.779 . . . . 74.109999999999999 110.409 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.15 -86.87 0.34 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.429 -0.582 . . . . 74.420000000000002 109.429 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.67 -60.43 0.69 Allowed Glycine 0 C--N 1.333 0.361 0 O-C-N 123.357 0.411 . . . . 64.439999999999998 112.915 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.4 p -75.47 -1.6 24.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.221 0.534 . . . . 72.109999999999999 110.958 -176.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 p -65.84 -31.87 73.07 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.544 . . . . 52.340000000000003 111.392 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -74.22 -45.79 45.94 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.927 -0.579 . . . . 71.219999999999999 111.486 -178.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.518 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 15.9 m-85 -153.09 167.4 29.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.49 0.662 . . . . 52.539999999999999 112.106 -173.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 54' ' ' THR . 1.8 pm0 -91.18 -51.41 5.33 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.353 -1.294 . . . . 74.400000000000006 111.402 -175.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.546 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 65.6 p -90.14 148.26 23.09 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 116.678 -0.237 . . . . 74.219999999999999 110.514 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.493 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 13.9 ptmm? -66.28 -26.21 67.23 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.337 -0.392 . . . . 62.219999999999999 110.478 -176.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -57.39 -42.81 82.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.766 -0.652 . . . . 75.519999999999996 111.049 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 72.2 mt-30 -93.92 -35.57 12.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.969 -0.56 . . . . 63.310000000000002 110.039 -177.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.493 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 15.6 ttt -62.01 -47.88 82.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.364 -0.835 . . . . 74.510000000000005 111.449 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.81 -30.59 71.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 51.520000000000003 111.05 -176.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.88 -5.35 43.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.113 -0.494 . . . . 63.43 111.446 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.79 ' HE3' ' HG2' ' A' ' 64' ' ' GLU . 28.9 mmmt -116.04 5.36 13.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.448 -0.342 . . . . 70.150000000000006 110.201 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -57.58 -54.84 42.3 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.306 -0.406 . . . . 71.109999999999999 110.249 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -68.64 -27.92 66.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.37 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.79 ' HG2' ' HE3' ' A' ' 61' ' ' LYS . 5.5 tp10 -65.23 -45.28 85.3 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 116.033 -0.531 . . . . 74.25 110.857 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.642 ' HA ' ' HE1' ' A' ' 68' ' ' TYR . 20.5 ptp -77.75 -26.28 49.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.402 0.62 . . . . 41.229999999999997 109.375 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.467 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 65.6 mtp -80.94 -29.69 35.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.551 -0.75 . . . . 71.439999999999998 112.563 -177.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -64.22 -40.09 95.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.074 0.464 . . . . 75.329999999999998 110.725 -169.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.682 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 36.4 p90 -88.04 -12.15 45.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.931 -0.577 . . . . 71.239999999999995 110.493 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.474 ' O ' ' HE1' ' B' ' 237' ' ' MET . 2.3 m-30 -60.55 -44.7 95.83 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.229 -0.188 . . . . 71.530000000000001 110.623 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.687 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.55 -49.68 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.975 0.417 . . . . 61.32 110.05 173.679 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -85.19 47.91 1.49 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.605 0.717 . . . . 75.510000000000005 110.757 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.682 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 1.9 mmp_? -113.06 -23.07 10.23 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 121.705 -0.622 . . . . 73.209999999999994 111.158 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 1.035 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 9.1 11.86 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.621 -0.432 . . . . 65.109999999999999 110.983 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -64.05 -59.16 4.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.485 -0.325 . . . . 72.219999999999999 110.531 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -55.82 -37.83 69.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 74.239999999999995 111.321 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.8 mtt -61.79 -42.11 98.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.484 0.659 . . . . 71.25 110.332 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' B' ' 245' ' ' ALA . 2.0 tt -69.18 -36.28 77.16 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.229 -0.896 . . . . 75.439999999999998 109.304 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.483 ' N ' ' HE1' ' B' ' 266' ' ' MET . 12.1 t70 -61.45 -43.27 99.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.02 -0.991 . . . . 74.019999999999996 110.805 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.06 -14.28 62.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.514 -0.766 . . . . 73.540000000000006 111.814 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -99.55 -4.98 29.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.82 0.343 . . . . 72.239999999999995 111.004 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.44 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 19.0 mmt -80.73 -178.76 6.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.334 0.588 . . . . 60.229999999999997 111.569 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.713 ' HG2' HD12 ' A' ' 85' ' ' ILE . 3.8 mt-10 67.64 -2.33 1.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.641 -1.163 . . . . 74.409999999999997 114.059 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.96 -53.99 45.17 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.031 0.443 . . . . 55.130000000000003 109.95 177.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -85.4 -9.52 57.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 63.149999999999999 111.255 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.713 HD12 ' HG2' ' A' ' 82' ' ' GLU . 61.6 mt -79.34 -62.2 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.889 0.376 . . . . 62.130000000000003 110.897 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.618 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -66.8 -24.08 66.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.346 -0.388 . . . . 74.540000000000006 110.72 -176.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.423 ' ND2' ' HG3' ' A' ' 86' ' ' GLU . 47.8 m-80 -107.07 16.69 23.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.057 -0.52 . . . . 71.430000000000007 111.111 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.553 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 63.3 t80 -53.94 -49.41 68.75 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.556 0.206 . . . . 75.5 111.556 -177.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 C--N 1.327 -0.39 0 CA-C-O 121.067 0.46 . . . . 64.010000000000005 111.273 -179.692 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.418 HD22 ' N ' ' B' ' 203' ' ' ASN . 0.9 OUTLIER . . . . . 0 CA--C 1.519 -0.236 0 CA-C-O 120.896 0.379 . . . . 74.239999999999995 110.247 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -96.35 100.28 11.9 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.18 -0.464 . . . . 74.549999999999997 110.794 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.9 25.22 3.9 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.748 0.785 . . . . 74.540000000000006 109.14 172.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -152.75 -176.24 5.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 74.450000000000003 111.904 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -130.16 42.15 3.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 71.310000000000002 110.254 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -52.14 -41.05 62.21 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.642 -0.708 . . . . 74.519999999999996 111.843 -177.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.09 -20.7 64.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 71.040000000000006 111.431 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -85.36 -65.2 1.04 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.287 -0.415 . . . . 71.439999999999998 110.091 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.627 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.82 -25.98 13.11 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.432 0.901 . . . . 70.420000000000002 113.432 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.8 t -65.63 -28.04 68.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.632 0.253 . . . . 72.409999999999997 111.318 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.7 -18.71 39.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.221 0.534 . . . . 65.109999999999999 110.251 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -71.37 -46.19 61.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.566 -0.743 . . . . 72.5 109.461 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.58 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.8 mt -67.2 -30.79 50.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.427 0.632 . . . . 72.549999999999997 109.905 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -57.55 -39.96 77.84 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.188 -0.914 . . . . 75.430000000000007 111.084 -177.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 14' ' ' LEU . 2.8 tm? -63.66 -42.6 98.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.354 -0.385 . . . . 71.439999999999998 110.052 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.41 -33.2 72.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 43.549999999999997 111.402 -177.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.79 -32.73 73.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.304 -0.407 . . . . 72.209999999999994 111.109 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -74.14 -28.22 61.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 72.439999999999998 111.264 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -85.18 -21.18 29.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.923 0.392 . . . . 74.510000000000005 110.519 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -78.13 -1.97 35.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.469 0.652 . . . . 73.439999999999998 109.854 175.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -79.45 -4.43 51.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.877 -0.601 . . . . 54.520000000000003 109.944 175.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.475 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -69.93 103.52 2.26 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.955 -0.758 . . . . 44.420000000000002 108.955 175.32 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.9 t -59.86 -26.51 65.91 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 113.287 0.847 . . . . 73.510000000000005 113.287 -171.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 226' ' ' GLU . . . . . 0.475 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.6 pm0 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.226 0.454 . . . . 64.329999999999998 112.226 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.41 HG13 HD22 ' B' ' 224' ' ' ASN . 4.2 mt -115.97 150.47 17.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.395 . . . . 72.319999999999993 110.943 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -88.76 166.35 14.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.094 -0.503 . . . . 74.099999999999994 109.783 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 10.4 m -67.22 -27.01 66.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.301 -0.409 . . . . 74.430000000000007 110.659 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -66.52 -27.44 73.16 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.938 -0.574 . . . . 61.25 113.322 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -74.4 -29.36 61.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.223 0.535 . . . . 73.340000000000003 109.778 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.8 t -76.29 -26.23 16.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 70.450000000000003 109.695 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 233' ' ' SER . . . . . 0.445 ' HA ' ' CE1' ' A' ' 43' ' ' TYR . 2.7 m -65.57 -24.68 67.15 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.819 -0.628 . . . . 75.420000000000002 109.75 174.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -85.51 -33.06 21.89 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.597 -0.729 . . . . 61.43 111.348 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.498 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 9.2 p -68.77 -34.36 75.44 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 120.7 -0.4 . . . . 61.210000000000001 110.41 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.64 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.3 t80 -67.18 -36.33 81.56 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.14 -0.689 . . . . 71.340000000000003 109.14 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 237' ' ' MET . . . . . 1.035 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.4 tpt -62.66 -57.5 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.142 -0.935 . . . . 64.120000000000005 110.554 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.498 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 31.1 t-105 -60.23 -35.62 75.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.455 -0.793 . . . . 73.209999999999994 111.643 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.504 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -62.65 -47.11 85.13 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.701 0.286 . . . . 71.400000000000006 110.945 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.562 HD13 ' HB3' ' A' ' 36' ' ' PHE . 40.0 tp -62.83 -28.21 69.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 72.120000000000005 110.872 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -66.09 -49.44 67.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 45.43 110.908 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.6 mtm180 -68.76 -23.7 64.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.401 . . . . 53.509999999999998 110.862 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.505 ' HD2' HG23 ' A' ' 15' ' ' ILE . 13.7 t80 -78.9 -26.41 43.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.238 -0.437 . . . . 73.510000000000005 110.58 -179.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -90.61 -24.75 20.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.854 0.316 . . . . 72.530000000000001 111.854 -178.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.488 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -83.66 2.3 38.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.532 0.682 . . . . 60.539999999999999 110.285 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -76.3 -9.21 58.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.803 -1.09 . . . . 64.430000000000007 109.929 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.56 ' HB3' ' OG1' ' B' ' 250' ' ' THR . 80.2 m-85 -95.94 -89.07 0.26 Allowed 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.912 -0.773 . . . . 75.319999999999993 108.912 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . 64.63 -66.73 0.07 OUTLIER Glycine 0 C--N 1.334 0.437 0 O-C-N 123.663 0.602 . . . . 52.030000000000001 113.325 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 3.5 p -75.06 -3.34 31.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.107 0.48 . . . . 63.5 111.043 -175.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 250' ' ' THR . . . . . 0.56 ' OG1' ' HB3' ' B' ' 247' ' ' PHE . 24.1 p -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.948 -0.569 . . . . 75.299999999999997 111.038 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.2 t -86.4 -39.88 15.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.897 -0.592 . . . . 63.310000000000002 111.236 -177.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.55 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 4.0 m-85 -147.67 179.24 7.84 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.772 0.656 . . . . 75.219999999999999 112.772 -173.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.505 ' HG3' ' N ' ' B' ' 254' ' ' THR . 7.9 pt-20 -89.7 -50.98 5.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.035 -0.984 . . . . 64.049999999999997 111.334 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.54 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 68.9 p -107.33 159.44 16.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.071 -0.513 . . . . 61.409999999999997 111.063 -173.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.553 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 20.2 ptmt -67.28 -32.07 72.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.471 -0.331 . . . . 74.510000000000005 110.814 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 256' ' ' GLU . . . . . 0.54 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.7 mp0 -57.56 -42.73 83.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.167 0.508 . . . . 74.439999999999998 110.46 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 78.7 mt-30 -89.7 -34.97 16.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.677 -0.692 . . . . 63.5 110.266 -177.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.404 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 14.8 ttt -63.5 -42.34 98.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.828 -0.624 . . . . 74.349999999999994 110.892 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.581 ' HG3' ' HE3' ' B' ' 262' ' ' LYS . 34.6 tt0 -62.64 -37.3 85.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 71.340000000000003 111.005 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.17 -9.0 50.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 52.420000000000002 111.159 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.55 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 30.9 mmmt -109.21 1.07 20.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.115 -0.493 . . . . 64.140000000000001 111.529 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.581 ' HE3' ' HG3' ' B' ' 259' ' ' GLN . 8.2 ptpp? -58.38 -39.74 80.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.711 0.291 . . . . 64.439999999999998 110.594 -175.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -90.1 -24.48 21.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 110.085 -0.339 . . . . 65.140000000000001 110.085 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 264' ' ' GLU . . . . . 0.415 ' HB2' ' HA ' ' B' ' 261' ' ' LYS . 45.8 mt-10 -75.17 -33.26 61.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 61.140000000000001 111.802 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.2 ptp -77.87 -30.42 50.82 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.073 -1.084 . . . . 72.109999999999999 108.073 175.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.483 ' HE1' ' N ' ' A' ' 78' ' ' ASP . 45.2 mtp -87.33 16.47 5.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.981 -1.008 . . . . 70.030000000000001 110.703 177.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -91.79 -37.71 12.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.249 0.547 . . . . 54.009999999999998 110.072 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.512 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 13.9 p90 -109.06 -5.91 15.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.879 -0.6 . . . . 63.439999999999998 110.925 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -57.75 -48.01 80.86 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.634 0.254 . . . . 75.409999999999997 110.752 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.687 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.71 -53.37 58.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.923 -0.581 . . . . 62.020000000000003 110.809 175.443 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.39 65.21 8.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.366 0.603 . . . . 74.420000000000002 111.444 -173.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.597 ' HB2' ' SD ' ' A' ' 37' ' ' MET . 85.2 mtm180 -125.63 -27.83 3.35 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.78 -0.645 . . . . 73.219999999999999 109.522 170.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.765 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -104.1 14.45 30.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.282 -0.417 . . . . 54.25 110.441 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -63.99 -58.76 5.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 75.25 109.828 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.51 -36.03 79.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 74.340000000000003 111.146 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 61.0 mtt -58.02 -46.77 84.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.316 0.579 . . . . 61.43 109.663 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.511 HD23 ' HB2' ' A' ' 45' ' ' ALA . 0.9 OUTLIER -67.02 -37.73 84.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.814 -1.085 . . . . 62.420000000000002 109.729 -177.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 278' ' ' ASP . . . . . 0.467 ' N ' ' HE1' ' A' ' 66' ' ' MET . 13.8 t70 -64.06 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.499 -0.773 . . . . 75.120000000000005 110.092 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -72.37 -18.3 61.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.661 -0.7 . . . . 63.520000000000003 111.144 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 280' ' ' ASN . . . . . 0.444 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m120 -89.64 -20.07 24.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.066 0.46 . . . . 72.239999999999995 109.798 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.46 ' C ' ' H ' ' B' ' 283' ' ' ASP . 24.3 mmt -73.67 -165.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 74.299999999999997 110.172 173.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 6.5 mm-40 66.48 -34.59 0.21 Allowed 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.339 1.056 . . . . 75.010000000000005 112.989 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 283' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' B' ' 281' ' ' MET . 18.2 t70 -47.9 -60.07 2.87 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.436 0.694 . . . . 63.420000000000002 112.236 -177.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -80.55 -13.33 59.16 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.213 -0.449 . . . . 65.439999999999998 110.808 -177.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 285' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.79 -53.61 13.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.116 -0.493 . . . . 72.109999999999999 110.307 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.596 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -63.15 -32.21 73.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.137 -0.483 . . . . 72.340000000000003 110.211 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 287' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 30.1 m-80 -90.49 11.96 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.792 -0.64 . . . . 75.310000000000002 111.922 -176.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 54' ' ' THR . 38.3 t80 -58.18 -43.4 87.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.86 -0.793 . . . . 74.420000000000002 108.86 172.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.47 -0.786 . . . . 63.530000000000001 110.343 173.992 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.491 ' HA ' ' HD2' ' A' ' 8' ' ' TYR . 4.6 p-10 . . . . . 0 N--CA 1.448 -0.566 0 CA-C-O 121.783 0.801 . . . . 72.340000000000003 109.209 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -84.22 -72.25 0.47 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.313 -0.858 . . . . 71.319999999999993 112.212 -169.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -89.46 -15.11 33.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.295 0.569 . . . . 55.210000000000001 110.712 -171.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . . . -139.13 167.11 22.8 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.944 -0.571 . . . . 75.230000000000004 111.615 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.53 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.66 47.35 1.17 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.17 -0.923 . . . . 73.230000000000004 111.398 -179.171 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.491 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 68.7 m-85 -49.66 -42.22 44.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.378 . . . . 74.120000000000005 111.907 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.18 -18.8 64.7 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.194 0.442 . . . . 73.510000000000005 112.194 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -83.62 -53.92 5.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.527 0.203 . . . . 73.510000000000005 111.06 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.752 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -66.74 -17.04 64.66 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.89 0.853 . . . . 45.030000000000001 109.932 -176.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -55.53 -35.93 66.19 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.03 -1.441 . . . . 74.439999999999998 111.535 175.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.658 ' HB2' HD11 ' B' ' 217' ' ' LEU . 25.6 mt-10 -83.68 -24.82 31.13 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.125 0.488 . . . . 74.5 110.126 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -67.12 -44.55 79.61 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.66 -0.7 . . . . 73.409999999999997 109.9 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 67.5 mt -73.48 -22.98 19.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.811 -0.631 . . . . 45.140000000000001 110.357 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -62.04 -34.98 77.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.889 -0.596 . . . . 70.439999999999998 110.622 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.561 HD12 HD13 ' B' ' 214' ' ' LEU . 2.5 tm? -72.71 -39.72 66.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.476 -0.564 . . . . 61.130000000000003 109.476 176.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.86 95.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.222 0.534 . . . . 71.230000000000004 110.23 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 88.7 m-20 -65.26 -23.09 66.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.869 -0.605 . . . . 73.140000000000001 110.908 177.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -74.1 -35.8 64.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.102 0.477 . . . . 42.119999999999997 110.149 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -81.23 -23.57 37.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.267 0.556 . . . . 54.130000000000003 110.137 178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -81.63 9.37 7.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.495 0.664 . . . . 73.129999999999995 110.201 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 96.7 mt-30 -83.81 -5.99 59.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.944 -0.571 . . . . 74.319999999999993 110.34 175.262 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.36 109.81 12.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.762 . . . . 62.399999999999999 108.941 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 25' ' ' THR . 3.7 t -65.35 -30.2 71.02 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.916 0.71 . . . . 52.229999999999997 112.916 -170.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -86.12 -11.73 51.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.761 0.652 . . . . 72.040000000000006 112.761 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.0 mt -96.05 144.97 9.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.38 0.61 . . . . 70.420000000000002 110.401 -178.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.524 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -79.7 153.64 29.15 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.272 -0.876 . . . . 75.450000000000003 109.703 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.4 m -62.63 -20.88 65.22 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.965 -0.561 . . . . 65.239999999999995 111.212 -177.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.72 -27.11 72.93 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.903 -0.59 . . . . 63.030000000000001 113.73 -177.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 12.0 mm-40 -75.35 -18.96 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.525 0.663 . . . . 63.130000000000003 110.262 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -86.46 -43.35 16.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.66 -0.7 . . . . 64.439999999999998 110.249 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.408 ' HB3' ' CD1' ' B' ' 243' ' ' TYR . 10.7 p -61.59 -39.26 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.111 -0.495 . . . . 62.219999999999999 110.519 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.67 -33.06 75.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.912 -0.585 . . . . 45.140000000000001 111.11 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.3 m -69.49 -35.77 75.88 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 43.229999999999997 110.059 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.512 ' CD1' HD12 ' B' ' 214' ' ' LEU . 8.1 t80 -67.9 -34.65 77.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.32 0.581 . . . . 74.230000000000004 109.509 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.806 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 13.0 ttm -67.0 -51.24 57.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.465 -0.789 . . . . 74.420000000000002 111.54 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 30.1 t-105 -60.65 -37.1 80.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.851 0.357 . . . . 73.230000000000004 110.584 178.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.56 -37.35 86.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 74.510000000000005 111.278 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.52 HD13 ' HB3' ' B' ' 236' ' ' PHE . 47.3 tp -70.01 -32.51 70.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.05 0.452 . . . . 61.009999999999998 110.22 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.522 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.45 -42.05 98.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.663 -0.699 . . . . 73.150000000000006 110.845 178.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 42' ' ' ARG . 39.5 mtp180 -69.94 -37.31 75.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.096 0.474 . . . . 75.450000000000003 110.558 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -74.54 -34.81 63.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.789 -0.641 . . . . 62.219999999999999 111.405 -173.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.7 m-20 -74.61 -28.82 61.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.644 0.259 . . . . 54.109999999999999 111.495 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.6 -19.25 63.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.554 . . . . 62.109999999999999 111.055 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -61.9 -27.88 69.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.128 -0.942 . . . . 73.25 110.738 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.476 ' O ' HG22 ' A' ' 50' ' ' THR . 60.0 m-85 -90.41 10.36 25.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.367 -0.379 . . . . 70.319999999999993 111.718 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.508 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.41 -27.16 73.5 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.416 -0.897 . . . . 71.219999999999999 111.423 176.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.776 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 26.1 p -67.57 -27.97 67.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 71.120000000000005 111.313 -177.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.3 t -90.89 12.83 18.25 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.152 0.501 . . . . 52.210000000000001 110.729 -176.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.1 t -78.99 -65.64 0.97 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.248 -0.433 . . . . 65.099999999999994 111.534 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.729 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 5.8 m-85 -133.02 -176.05 3.99 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.559 0.578 . . . . 71.329999999999998 112.559 -172.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.1 pt-20 -92.62 -48.69 6.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.065 -0.97 . . . . 63.009999999999998 111.415 -172.218 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.487 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.3 p -105.25 156.59 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.244 -0.435 . . . . 60.149999999999999 110.065 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.515 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.8 ptmm? -70.52 -25.28 63.05 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.837 -0.345 . . . . 75.25 110.882 -175.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -72.05 -42.21 66.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.084 -0.246 . . . . 71.019999999999996 110.917 -178.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.763 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 98.8 mt-30 -74.15 -45.15 50.53 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 73.040000000000006 109.637 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.776 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 17.2 ttt -57.88 -40.68 80.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 72.120000000000005 111.684 -179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.541 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.5 tt0 -63.53 -36.59 84.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.95 0.405 . . . . 72.109999999999999 111.14 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.77 9.37 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.127 -0.488 . . . . 72.450000000000003 111.12 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.763 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 71.5 mmtt -115.21 -1.99 12.82 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-N 116.223 -0.444 . . . . 73.0 110.241 -177.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.478 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.2 ptmt -54.38 -56.5 18.01 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.431 -0.804 . . . . 62.240000000000002 110.393 -178.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.478 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.0 tp60 -70.25 -23.17 62.85 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.775 -0.193 . . . . 64.0 110.627 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -71.17 -41.48 70.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.44 -0.345 . . . . 62.020000000000003 110.612 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.508 ' SD ' ' HA2' ' A' ' 48' ' ' GLY . 20.2 ptp -81.96 -25.44 34.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.487 0.661 . . . . 71.299999999999997 109.309 -179.154 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.486 ' HG2' HD22 ' B' ' 277' ' ' LEU . 69.3 mtp -82.03 -25.25 34.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.426 -0.806 . . . . 75.140000000000001 111.785 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 23.9 t70 -64.23 -33.09 75.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.965 0.412 . . . . 74.319999999999993 110.582 -169.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -98.01 -14.28 20.64 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.021 -0.536 . . . . 74.400000000000006 110.548 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.439 ' HB2' ' HA ' ' A' ' 66' ' ' MET . 1.0 OUTLIER -57.66 -53.3 59.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 110.08 -0.341 . . . . 65.530000000000001 110.08 174.771 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.783 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -46.98 -58.53 3.87 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.615 -0.72 . . . . 73.430000000000007 110.879 174.877 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.595 ' OD1' ' HG2' ' B' ' 270' ' ' MET . 5.7 t0 -91.96 28.44 1.84 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.867 -0.606 . . . . 73.319999999999993 111.605 -169.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.446 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 4.6 mtp180 -84.45 -42.39 15.67 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.043 0.449 . . . . 63.329999999999998 110.555 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.75 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.0 OUTLIER -87.78 19.58 3.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.258 0.551 . . . . 73.549999999999997 109.686 -178.445 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 25.2 tttp -57.11 -66.0 0.53 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.039 -0.982 . . . . 74.310000000000002 110.732 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -64.41 -27.23 68.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 64.209999999999994 110.949 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.4 mtt -66.3 -38.02 86.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.484 0.659 . . . . 72.409999999999997 110.067 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.57 HD22 ' HG2' ' B' ' 266' ' ' MET . 5.4 tt -76.83 -37.37 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.246 -0.888 . . . . 73.209999999999994 109.811 -178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.623 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 13.2 t70 -59.55 -41.19 89.56 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.962 -0.563 . . . . 74.409999999999997 110.421 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.24 -5.63 33.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.287 -0.87 . . . . 64.209999999999994 111.83 -177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -105.67 -4.44 21.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.954 -0.298 . . . . 75.109999999999999 111.205 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 51.7 mtt -95.86 -172.87 2.69 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.842 0.353 . . . . 74.120000000000005 110.839 175.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.697 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 36.3 mt-10 67.12 -6.5 0.58 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.021 0.928 . . . . 74.329999999999998 113.466 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.56 -54.91 38.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.74 0.305 . . . . 51.420000000000002 110.783 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -9.12 49.03 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 120.959 0.409 . . . . 61.310000000000002 110.179 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.697 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -70.43 -57.03 8.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.869 0.366 . . . . 43.149999999999999 110.077 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -68.45 -17.95 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 73.439999999999998 110.733 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -109.32 14.56 23.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 60.530000000000001 111.487 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -58.68 -51.82 68.32 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.73 0.3 . . . . 74.510000000000005 110.296 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 116.097 -0.501 . . . . 71.530000000000001 110.273 178.269 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 109.71 -0.478 . . . . 74.120000000000005 109.71 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -78.34 -81.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.57 -0.286 . . . . 74.310000000000002 110.479 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -112.23 -47.06 3.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.896 0.379 . . . . 70.200000000000003 110.623 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -80.26 155.84 27.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.031 0.443 . . . . 64.349999999999994 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.11 51.93 0.7 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.379 -0.828 . . . . 60.100000000000001 112.602 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -56.99 -32.96 66.63 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.976 0.362 . . . . 62.399999999999999 111.976 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -81.1 -7.72 59.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.888 0.329 . . . . 62.200000000000003 111.888 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -94.1 -62.5 1.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.371 -0.233 . . . . 71.510000000000005 110.371 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.725 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.75 -26.34 13.86 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.844 0.683 . . . . 60.130000000000003 112.844 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.01 -18.5 65.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.187 -0.205 . . . . 71.209999999999994 111.534 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.51 -25.61 22.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.296 0.569 . . . . 52.329999999999998 109.573 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.725 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.64 -47.32 69.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 73.209999999999994 109.475 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.456 HG13 ' HB1' ' A' ' 39' ' ' ALA . 71.1 mt -66.56 -29.96 48.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.47 -0.786 . . . . 71.510000000000005 110.667 178.154 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -59.14 -36.51 75.36 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.925 -0.58 . . . . 74.099999999999994 110.758 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.658 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.5 tm? -68.65 -43.75 75.59 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.432 -0.581 . . . . 70.340000000000003 109.432 178.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 218' ' ' ALA . . . . . 0.404 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -60.2 -40.9 91.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 42.530000000000001 110.613 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.577 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 84.8 m-20 -60.36 -30.85 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 71.319999999999993 111.199 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.53 -30.05 62.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.338 . . . . 73.010000000000005 111.18 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -84.26 -24.33 29.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.584 0.707 . . . . 73.549999999999997 109.804 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -72.63 -9.47 58.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.881 -1.054 . . . . 72.409999999999997 110.127 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 93.9 mt-30 -76.99 -6.96 54.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.729 -0.669 . . . . 72.230000000000004 111.252 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -72.77 111.86 8.29 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.603 -0.517 . . . . 64.409999999999997 109.603 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 225' ' ' THR . . . . . 0.434 ' H ' HG22 ' B' ' 225' ' ' THR . 1.8 t -61.78 -35.51 78.36 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.142 0.793 . . . . 71.209999999999994 113.142 -171.456 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.57 -1.22 57.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.589 0.589 . . . . 73.219999999999999 112.589 -176.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 7.0 mt -107.69 153.19 9.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 C-N-CA 120.621 -0.432 . . . . 61.149999999999999 110.125 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.685 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 10.4 pt20 -91.99 159.04 15.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.592 -0.521 . . . . 63.399999999999999 109.592 177.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 1.1 m -59.67 -26.56 65.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.253 -0.43 . . . . 64.319999999999993 111.141 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -65.84 -26.36 72.15 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.629 -0.714 . . . . 62.509999999999998 113.695 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.685 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 5.7 mm-40 -78.8 -24.53 44.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.387 0.593 . . . . 71.239999999999995 109.615 -178.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 232' ' ' VAL . . . . . 0.404 HG11 ' O ' ' B' ' 218' ' ' ALA . 26.3 t -82.24 -41.84 18.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.44 -0.8 . . . . 63.43 110.092 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 13.3 p -62.3 -37.35 85.23 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.112 -0.494 . . . . 72.329999999999998 110.121 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.04 76.63 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.889 -0.596 . . . . 74.450000000000003 110.882 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 42.3 m -68.41 -35.65 77.97 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.855 0.359 . . . . 63.140000000000001 110.045 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.578 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.55 -38.01 83.51 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.294 -0.632 . . . . 75.040000000000006 109.294 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.75 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -62.13 -53.05 60.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.097 -0.956 . . . . 74.209999999999994 110.948 176.919 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -61.81 -38.67 89.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.125 -0.489 . . . . 74.109999999999999 111.114 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.653 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.37 -41.34 96.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.376 -0.374 . . . . 70.140000000000001 111.423 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.98 -34.39 78.31 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 120.666 0.27 . . . . 75.109999999999999 110.371 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.48 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -62.47 -39.14 92.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.367 -0.379 . . . . 74.209999999999994 111.104 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -73.3 -34.94 66.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.146 0.498 . . . . 65.129999999999995 110.339 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.408 ' CD1' ' HB3' ' A' ' 33' ' ' SER . 4.3 t80 -80.94 -30.4 35.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.604 -0.725 . . . . 74.349999999999994 110.585 -175.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -77.46 -40.59 42.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 72.120000000000005 110.824 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -62.35 -17.82 59.9 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.098 0.475 . . . . 72.519999999999996 111.274 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -59.32 -26.87 65.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.284 -0.871 . . . . 75.329999999999998 111.307 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.429 ' O ' HG22 ' B' ' 250' ' ' THR . 67.4 m-85 -89.6 1.36 56.09 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.373 -0.376 . . . . 72.219999999999999 111.511 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -63.72 -29.47 74.83 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.067 -1.063 . . . . 72.310000000000002 111.144 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 22.5 m -71.15 -6.97 43.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.102 0.408 . . . . 73.409999999999997 112.102 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 250' ' ' THR . . . . . 0.429 HG22 ' O ' ' B' ' 247' ' ' PHE . 12.8 t -115.6 16.99 16.46 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.0 0.429 . . . . 43.140000000000001 110.623 176.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.2 t -83.97 -59.16 2.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.346 -0.388 . . . . 62.299999999999997 110.876 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.723 ' CE2' ' HG2' ' B' ' 261' ' ' LYS . 1.6 m-85 -126.96 172.97 9.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.618 0.247 . . . . 71.519999999999996 111.006 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 7.8 pt-20 -94.1 -42.55 8.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.053 -0.522 . . . . 65.109999999999999 111.727 -173.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 50.7 p -100.16 154.12 18.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.508 -0.315 . . . . 71.540000000000006 110.39 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -65.1 -30.75 71.71 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.9 -0.32 . . . . 71.140000000000001 110.595 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -66.85 -45.93 76.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.014 0.435 . . . . 73.409999999999997 110.88 -178.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.568 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 96.3 mt-30 -80.19 -24.77 40.08 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.147 -0.479 . . . . 73.409999999999997 110.768 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.483 ' SD ' HG12 ' A' ' 85' ' ' ILE . 20.3 ttt -76.34 -39.24 54.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.459 . . . . 70.150000000000006 110.214 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.554 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.0 tt0 -67.8 -49.01 64.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.611 . . . . 71.409999999999997 111.651 -177.658 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.26 66.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.128 0.49 . . . . 74.310000000000002 110.641 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.723 ' HG2' ' CE2' ' B' ' 252' ' ' PHE . 13.6 mptt -95.89 8.67 42.98 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.47 -0.787 . . . . 33.549999999999997 111.487 -175.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.629 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 15.2 ptpt -52.82 -45.74 67.43 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.309 -0.626 . . . . 74.540000000000006 109.309 175.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.629 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 10.2 tp60 -75.0 -24.07 58.34 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.99 -0.55 . . . . 72.530000000000001 110.858 -175.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.25 -46.31 74.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.571 0.224 . . . . 74.340000000000003 110.936 178.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.51 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.7 ptt? -78.4 -33.21 48.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.279 -0.568 . . . . 64.200000000000003 109.736 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.623 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 45.8 mtp -83.13 21.65 1.06 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.796 -0.638 . . . . 64.040000000000006 111.0 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 267' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 34.7 t70 -109.45 -25.08 10.69 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.659 -0.497 . . . . 62.130000000000003 109.659 174.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.488 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 18.3 p90 -113.81 -20.62 11.05 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.423 -0.511 . . . . 70.140000000000001 111.651 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -54.63 -48.24 72.5 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.097 0.475 . . . . 73.25 110.388 177.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.595 ' HG2' ' OD1' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -53.88 -47.67 70.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.238 -0.892 . . . . 65.420000000000002 110.584 175.568 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 271' ' ' ASP . . . . . 0.482 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 5.4 t70 -78.89 7.11 7.68 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.485 -1.234 . . . . 74.549999999999997 111.801 -170.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 6.9 mtp180 -84.02 -26.42 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.918 -0.489 . . . . 71.25 111.669 -171.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.806 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -106.9 15.07 25.84 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.707 -0.397 . . . . 73.099999999999994 110.258 179.15 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.446 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 26.3 ttmt -60.78 -53.82 52.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.96 -0.563 . . . . 75.209999999999994 110.71 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -64.31 -36.4 84.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.966 0.412 . . . . 61.25 110.801 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.4 mtt -58.91 -43.75 91.12 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 74.319999999999993 110.031 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 1.3 tt -72.4 -39.1 68.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.303 -0.862 . . . . 71.230000000000004 109.753 -178.093 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 278' ' ' ASP . . . . . 0.434 ' N ' ' HE1' ' A' ' 66' ' ' MET . 20.6 t70 -62.19 -34.84 77.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.403 -0.817 . . . . 71.109999999999999 111.005 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -83.5 -6.94 59.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.594 -0.73 . . . . 74.129999999999995 111.913 -178.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -104.2 -3.77 23.95 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.571 -0.452 . . . . 75.409999999999997 111.24 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.447 ' HE3' ' CD2' ' B' ' 277' ' ' LEU . 42.0 mtt -89.82 -167.04 1.74 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.234 -0.439 . . . . 53.409999999999997 111.293 176.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.4 mt-10 70.29 -12.25 0.52 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.057 -0.974 . . . . 75.129999999999995 113.376 176.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -57.97 -57.76 11.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.051 0.453 . . . . 71.239999999999995 110.129 175.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -72.58 -16.24 61.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.043 -0.526 . . . . 65.510000000000005 111.475 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' B' ' 282' ' ' GLU . 56.1 mt -76.55 -56.98 6.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.488 -0.323 . . . . 64.340000000000003 110.234 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.3 pt-20 -62.18 -34.19 75.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 72.099999999999994 110.775 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -87.99 6.56 35.37 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.344 -0.389 . . . . 71.540000000000006 111.724 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.515 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 44.2 t80 -56.43 -47.76 78.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.321 -0.622 . . . . 64.420000000000002 109.321 174.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 14.6 t70 . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 115.748 -0.66 . . . . 71.510000000000005 110.407 176.11 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.9 p-10 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 109.81 -0.441 . . . . 51.32 109.81 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.598 ' HB3' ' HE2' ' A' ' 8' ' ' TYR . 37.5 tt0 -65.8 -81.12 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.19 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -124.14 -27.56 3.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.175 0.512 . . . . 73.120000000000005 110.24 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -106.38 167.86 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.004 -0.544 . . . . 61.549999999999997 111.329 -175.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -78.7 47.18 0.71 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.427 -0.806 . . . . 74.209999999999994 111.643 -178.956 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.598 ' HE2' ' HB3' ' A' ' 4' ' ' GLU . 75.2 m-85 -49.37 -48.54 46.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 71.439999999999998 111.591 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -26.27 67.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.041 -0.527 . . . . 23.199999999999999 112.2 -175.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 10' ' ' ARG . 27.1 mmt180 -81.39 -51.49 8.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.269 -0.172 . . . . 71.109999999999999 111.404 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.656 ' HB1' ' HB2' ' B' ' 239' ' ' ALA . . . -63.6 -23.5 67.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.874 0.845 . . . . 70.439999999999998 109.701 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -58.63 -33.47 70.08 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.124 -1.398 . . . . 72.310000000000002 111.22 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.593 ' HB2' HD11 ' B' ' 217' ' ' LEU . 28.1 mt-10 -79.15 -31.9 44.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.374 0.607 . . . . 75.409999999999997 109.469 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.634 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -63.01 -43.46 98.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.019 -0.991 . . . . 75.25 109.533 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.68 HG23 ' HD2' ' B' ' 243' ' ' TYR . 84.9 mt -69.91 -33.09 54.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.348 -0.842 . . . . 72.450000000000003 110.598 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -31.14 71.19 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.9 -0.591 . . . . 74.530000000000001 111.055 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.548 HD12 HD22 ' B' ' 214' ' ' LEU . 2.8 tm? -69.71 -45.92 67.12 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.05 -0.722 . . . . 72.329999999999998 109.05 176.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.77 -39.27 84.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.968 -0.56 . . . . 71.209999999999994 110.808 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.91 -21.47 66.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.281 -0.418 . . . . 72.430000000000007 111.396 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -80.79 -33.95 34.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.012 0.435 . . . . 72.5 109.865 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -78.69 -24.3 45.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.245 0.545 . . . . 75.430000000000007 110.025 177.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.492 ' OD1' HG23 ' A' ' 29' ' ' THR . 0.2 OUTLIER -70.49 -10.91 60.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.49 -0.777 . . . . 65.530000000000001 109.577 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -78.83 -9.75 59.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.584 -0.734 . . . . 75.120000000000005 110.737 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.43 159.64 33.84 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.154 0.502 . . . . 64.340000000000003 110.977 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.6 t -121.37 -16.57 7.84 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.469 -0.787 . . . . 72.099999999999994 110.239 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.74 3.71 49.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.515 -0.766 . . . . 74.0 111.021 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.726 HG22 ' H ' ' A' ' 28' ' ' GLN . 1.6 mt -128.25 -174.72 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.129999999999995 109.742 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.843 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 41.5 mt-30 -120.4 160.57 22.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.389 -0.597 . . . . 45.229999999999997 109.389 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.519 HG22 ' HZ ' ' B' ' 247' ' ' PHE . 58.6 m -64.01 -38.56 91.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.024 0.44 . . . . 73.450000000000003 110.802 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.56 74.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.086 -0.578 . . . . 71.450000000000003 112.979 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.843 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 8.5 mm-40 -68.99 -35.76 77.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.312 0.577 . . . . 64.329999999999998 109.596 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.41 HG21 ' HA ' ' A' ' 22' ' ' ASN . 47.8 t -63.84 -43.97 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.176 -0.92 . . . . 71.400000000000006 109.819 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.1 t -61.08 -42.93 99.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.719 -0.673 . . . . 73.400000000000006 110.438 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.888 -0.596 . . . . 61.340000000000003 111.279 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.518 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 16.2 m -66.71 -33.13 74.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.775 -0.454 . . . . 71.120000000000005 109.775 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.647 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.0 t80 -67.11 -41.09 86.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.3 0.572 . . . . 72.230000000000004 109.538 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.72 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.0 ttm -64.65 -48.47 74.7 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.51 -0.768 . . . . 75.120000000000005 111.427 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.517 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 27.4 t-105 -64.21 -37.15 86.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.387 . . . . 74.340000000000003 110.916 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.581 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -65.44 -36.38 83.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.962 0.41 . . . . 33.539999999999999 110.657 178.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.756 HD21 ' SD ' ' B' ' 237' ' ' MET . 58.6 tp -68.52 -36.96 79.58 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 74.420000000000002 109.703 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -33.25 71.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.644 -0.707 . . . . 65.310000000000002 111.076 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -78.5 -52.51 8.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.13 -0.486 . . . . 74.120000000000005 110.733 178.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.445 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 20.2 t80 -65.42 -42.28 92.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.39 -0.823 . . . . 74.230000000000004 111.549 -173.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -80.24 -25.14 39.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.405 -0.362 . . . . 64.310000000000002 111.652 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.616 ' HB2' ' HG ' ' B' ' 277' ' ' LEU . . . -81.28 -21.03 39.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.081 0.467 . . . . 74.120000000000005 110.54 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.445 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 11.3 t90 -56.63 -32.92 65.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 71.129999999999995 110.553 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -72.51 -9.0 58.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 71.200000000000003 111.532 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.79 -30.92 74.86 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.468 -0.872 . . . . 70.129999999999995 111.066 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 t -71.62 -2.96 18.99 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.747 0.308 . . . . 43.140000000000001 111.212 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -127.25 16.18 7.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.194 0.521 . . . . 53.340000000000003 109.978 174.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.5 t -74.17 -47.9 32.74 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.943 -0.571 . . . . 70.129999999999995 111.203 -175.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.643 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -134.03 -176.09 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.126 0.489 . . . . 74.209999999999994 112.078 -176.48 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.643 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.2 pt-20 -97.63 -25.59 15.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.133 -0.939 . . . . 75.510000000000005 111.881 -171.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.536 ' HA ' ' CE2' ' B' ' 288' ' ' PHE . 67.7 p -135.92 157.76 46.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 109.785 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.561 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 9.8 ptmm? -71.64 -30.59 65.93 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.547 -0.461 . . . . 72.040000000000006 110.322 -177.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.74 -38.78 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 61.200000000000003 110.414 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.697 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 97.9 mt-30 -88.05 -38.14 15.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.74 -0.664 . . . . 63.219999999999999 110.265 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.5 ttt -60.07 -40.86 91.01 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.144 0.497 . . . . 72.519999999999996 111.182 178.084 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -63.37 -31.39 72.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.607 -0.724 . . . . 62.240000000000002 110.823 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.78 1.89 47.79 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.044 -0.525 . . . . 64.310000000000002 111.07 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -111.9 -0.99 15.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.092 -0.504 . . . . 71.230000000000004 109.715 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 8.3 ttmm -51.39 -62.7 1.46 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.413 -0.812 . . . . 72.530000000000001 110.285 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -75.64 -11.92 60.1 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.548 -0.751 . . . . 63.210000000000001 110.471 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.42 -49.89 17.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.668 . . . . 73.120000000000005 110.767 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.507 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.2 ptt? -79.76 -26.7 40.61 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.253 0.549 . . . . 75.430000000000007 109.846 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.444 ' HG2' HD22 ' B' ' 277' ' ' LEU . 92.4 mtp -79.14 -2.12 39.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.641 -0.709 . . . . 72.129999999999995 110.522 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -74.47 -27.57 60.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.418 -0.956 . . . . 61.299999999999997 108.418 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.462 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 26.5 m-85 -102.82 -30.12 11.04 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.111 -1.404 . . . . 75.349999999999994 111.995 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -56.28 -58.31 8.52 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.011 -0.737 . . . . 73.219999999999999 109.011 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.523 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -56.9 -59.53 4.9 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.499 -0.318 . . . . 75.120000000000005 110.992 173.31 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -107.42 75.59 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.703 0.631 . . . . 73.129999999999995 112.703 -170.18 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.462 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 2.1 mmm180 -140.52 -29.95 0.67 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.841 -0.618 . . . . 74.340000000000003 110.323 166.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.05 7.42 24.69 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.727 -0.842 . . . . 71.200000000000003 108.727 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -59.59 -60.22 4.19 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.732 -1.122 . . . . 62.109999999999999 110.417 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.31 -32.39 73.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.89 -0.595 . . . . 73.010000000000005 111.517 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.465 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 53.0 mtt -59.76 -48.92 79.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.556 0.693 . . . . 72.109999999999999 109.321 172.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.737 HD21 ' HD2' ' B' ' 269' ' ' TYR . 17.6 tp -63.32 -38.27 90.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.416 -1.266 . . . . 74.120000000000005 110.628 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.406 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -63.19 -53.93 45.48 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.771 -0.65 . . . . 64.129999999999995 110.199 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.12 -12.92 61.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.064 -0.971 . . . . 65.219999999999999 111.604 -178.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.0 -10.26 39.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.383 -0.371 . . . . 64.310000000000002 110.939 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.46 ' O ' HG13 ' A' ' 85' ' ' ILE . 63.4 mtt -101.12 -55.28 2.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 72.209999999999994 111.246 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.582 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 11.5 pt-20 -68.64 -14.89 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.852 0.686 . . . . 73.450000000000003 112.852 -169.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.09 -33.27 70.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.445 -0.576 . . . . 62.200000000000003 109.445 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -77.23 -38.41 51.28 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.859 -0.61 . . . . 75.340000000000003 110.215 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.647 HD13 ' HA ' ' B' ' 259' ' ' GLN . 68.1 mt -59.22 -54.84 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.854 -0.612 . . . . 72.409999999999997 110.932 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.829 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 8.4 pt-20 -58.82 -33.87 70.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.454 -0.339 . . . . 70.310000000000002 111.559 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -94.24 17.51 12.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.681 -0.236 . . . . 64.519999999999996 111.497 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.494 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 22.2 t80 -53.14 -51.69 61.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.707 -0.224 . . . . 74.409999999999997 110.996 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.246 -0.434 . . . . 75.140000000000001 111.27 -179.587 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.3 p-10 . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 109.053 -0.721 . . . . 74.430000000000007 109.053 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.46 -92.51 0.12 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.88 0.371 . . . . 73.519999999999996 110.975 -176.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -95.4 -28.75 14.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.437 0.637 . . . . 71.099999999999994 109.483 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -103.87 160.58 14.68 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.26 -0.882 . . . . 70.409999999999997 110.882 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.518 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -82.06 48.34 1.23 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.978 -1.01 . . . . 63.119999999999997 111.617 -177.641 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.517 ' HD2' ' HA ' ' B' ' 203' ' ' ASN . 53.7 m-85 -46.98 -53.55 12.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.242 -0.435 . . . . 75.099999999999994 111.921 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 209' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -58.88 -36.4 74.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.897 -0.592 . . . . 61.119999999999997 112.247 -176.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.483 ' O ' HD23 ' B' ' 214' ' ' LEU . 35.7 mmt180 -71.63 -48.94 44.58 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 111.75 0.278 . . . . 61.240000000000002 111.75 -176.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 39' ' ' ALA . . . -63.88 -26.54 68.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.951 0.882 . . . . 75.430000000000007 109.585 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 212' ' ' THR . . . . . 0.416 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 3.1 m -62.54 -32.73 73.73 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.254 -1.339 . . . . 70.109999999999999 111.611 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 32.8 mt-10 -75.35 -28.75 59.71 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.553 0.692 . . . . 72.450000000000003 109.247 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.647 HD12 ' CD1' ' A' ' 36' ' ' PHE . 3.4 mm? -65.37 -44.39 87.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.996 -1.002 . . . . 75.329999999999998 109.578 176.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.435 HG23 ' HD2' ' A' ' 43' ' ' TYR . 75.2 mt -69.15 -27.93 36.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.441 -0.799 . . . . 73.150000000000006 110.389 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 14.2 tmtt? -60.15 -35.09 74.53 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.079 -0.51 . . . . 61.219999999999999 110.931 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.0 tm? -69.77 -42.25 74.07 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.968 -0.753 . . . . 74.129999999999995 108.968 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.33 84.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.84 -0.618 . . . . 74.010000000000005 110.797 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 93.6 m-20 -60.61 -26.11 66.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 72.219999999999999 111.165 179.111 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -31.85 43.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.594 -0.276 . . . . 72.439999999999998 111.2 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -80.69 -28.06 36.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.479 0.656 . . . . 71.109999999999999 110.594 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -75.44 -1.47 24.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.185 -0.916 . . . . 71.120000000000005 110.672 -178.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.9 mm-40 -79.28 -0.56 32.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.06 -0.518 . . . . 73.310000000000002 111.613 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.478 ' OD1' HG13 ' B' ' 227' ' ' ILE . 1.8 t-20 -80.06 164.9 23.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.015 0.436 . . . . 63.210000000000001 110.49 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 1.5 t -96.18 -40.11 9.35 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.82 -0.627 . . . . 50.329999999999998 112.468 -173.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.16 3.18 43.64 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 112.91 0.707 . . . . 75.239999999999995 112.91 -175.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.478 HG13 ' OD1' ' B' ' 224' ' ' ASN . 12.7 mt -94.88 147.41 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 C-N-CA 120.192 -0.603 . . . . 71.420000000000002 109.565 175.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.577 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 37.2 mt-30 -84.01 147.37 27.46 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.569 -0.741 . . . . 73.409999999999997 109.365 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 7.8 m -57.3 -27.43 62.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.277 0.561 . . . . 54.140000000000001 110.282 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -76.65 -21.16 75.4 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.577 -0.738 . . . . 60.350000000000001 113.41 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.577 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 12.4 mm-40 -72.29 -30.98 65.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.64 0.72 . . . . 60.25 110.088 -176.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.3 t -69.73 -39.85 78.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.293 -0.867 . . . . 72.209999999999994 109.502 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.9 t -62.56 -38.49 90.29 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.78 -0.645 . . . . 61.140000000000001 109.744 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.27 -36.33 82.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.949 -0.568 . . . . 71.420000000000002 110.796 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.475 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.2 m -66.44 -35.21 79.74 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.686 -0.487 . . . . 73.129999999999995 109.686 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.558 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.0 t80 -66.96 -37.57 84.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.774 -0.648 . . . . 74.549999999999997 109.655 176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.756 ' SD ' HD21 ' A' ' 40' ' ' LEU . 8.6 tpt -63.64 -52.45 60.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 75.340000000000003 110.729 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.465 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 22.3 t-105 -63.48 -38.41 91.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.96 -0.564 . . . . 74.409999999999997 111.332 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.656 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -65.72 -31.85 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.547 -0.297 . . . . 60.409999999999997 111.392 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' B' ' 244' ' ' ASN . 44.4 tp -64.85 -38.52 91.27 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.864 -0.421 . . . . 62.109999999999999 109.864 177.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.543 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 71.209999999999994 110.312 177.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 242' ' ' ARG . . . . . 0.409 ' HA ' ' NE ' ' B' ' 242' ' ' ARG . 1.0 OUTLIER -58.68 -48.86 79.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 75.219999999999999 111.53 178.022 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.68 ' HD2' HG23 ' A' ' 15' ' ' ILE . 11.3 t80 -75.33 -36.85 60.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.968 -0.56 . . . . 73.340000000000003 111.494 -173.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 244' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' B' ' 240' ' ' LEU . 9.0 t-20 -74.88 -40.52 60.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.835 0.35 . . . . 74.109999999999999 111.266 -176.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.426 ' HB2' HD12 ' A' ' 77' ' ' LEU . . . -66.82 -22.47 66.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.932 0.396 . . . . 62.229999999999997 111.272 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 246' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' B' ' 243' ' ' TYR . 13.2 t90 -57.56 -31.81 66.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.606 -0.724 . . . . 63.340000000000003 110.565 175.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.519 ' HZ ' HG22 ' A' ' 29' ' ' THR . 71.3 m-85 -74.79 -11.03 60.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.238 -0.437 . . . . 73.019999999999996 111.526 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -70.13 -31.35 69.27 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.477 -0.868 . . . . 55.340000000000003 111.186 175.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 249' ' ' SER . . . . . 0.86 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 22.6 t -74.15 -7.84 54.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.807 0.337 . . . . 70.349999999999994 110.942 -176.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -120.86 21.59 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.354 0.597 . . . . 71.219999999999999 109.613 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 7.2 t -91.0 -38.69 12.66 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.691 -0.686 . . . . 62.200000000000003 111.289 -175.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.617 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -138.0 -170.07 2.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.204 0.526 . . . . 75.519999999999996 111.955 -176.888 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' B' ' 254' ' ' THR . 14.7 pt-20 -100.38 -49.82 4.12 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.349 -0.842 . . . . 73.329999999999998 111.237 -176.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.414 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 70.4 p -111.28 155.98 22.2 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.521 -0.309 . . . . 42.329999999999998 110.391 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.829 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 5.9 ptmm? -68.29 -27.26 66.16 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.812 -0.355 . . . . 62.32 110.588 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.25 -53.86 53.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.135 0.493 . . . . 71.319999999999993 110.327 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.692 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 81.7 mt-30 -79.1 -36.01 41.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.717 -0.674 . . . . 73.310000000000002 110.372 -177.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.86 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 20.4 ttt -61.9 -40.04 94.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.747 -0.661 . . . . 53.149999999999999 111.047 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.647 ' HA ' HD13 ' A' ' 85' ' ' ILE . 4.8 tp-100 -59.98 -41.57 92.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.957 -0.565 . . . . 70.109999999999999 110.823 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.99 -17.29 62.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.777 -0.647 . . . . 71.310000000000002 111.064 -178.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.692 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.3 mmmt -91.58 -18.16 24.5 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 116.118 -0.492 . . . . 72.230000000000004 110.523 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 262' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -48.41 -61.64 1.91 Allowed 'General case' 0 N--CA 1.443 -0.818 0 O-C-N 123.709 0.63 . . . . 53.409999999999997 110.439 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.01 -26.02 65.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.004 -0.544 . . . . 73.129999999999995 111.021 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -74.26 -35.94 63.81 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.988 -0.285 . . . . 75.219999999999999 111.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 19.0 ptp -83.65 -25.32 30.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.104 -0.702 . . . . 61.409999999999997 109.104 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.406 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 58.9 mtp -80.7 -24.67 38.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.16 -0.927 . . . . 73.409999999999997 111.784 179.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.18 -35.69 71.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.909 0.385 . . . . 62.43 111.93 -168.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.59 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 25.2 p90 -103.33 -3.41 25.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.291 -0.413 . . . . 70.140000000000001 110.903 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.737 ' HD2' HD21 ' A' ' 77' ' ' LEU . 2.1 m-30 -65.84 -42.72 90.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.452 0.168 . . . . 75.409999999999997 111.115 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 270' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -44.62 83.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.538 0.685 . . . . 74.200000000000003 109.577 174.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -86.06 17.39 3.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.98 -1.009 . . . . 73.349999999999994 111.621 -172.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.59 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 2.0 mmm180 -89.61 -47.88 7.67 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.501 -0.749 . . . . 64.450000000000003 110.94 -174.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.72 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.22 12.23 33.63 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.099 0.476 . . . . 72.239999999999995 109.796 -176.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -58.43 -57.98 10.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.41 -0.814 . . . . 63.229999999999997 110.341 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -60.76 -37.99 83.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.723 -0.671 . . . . 64.200000000000003 111.111 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 48.9 mtt -59.59 -45.55 91.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.433 0.635 . . . . 55.329999999999998 110.092 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.616 ' HG ' ' HB2' ' A' ' 45' ' ' ALA . 6.3 tt -71.56 -42.1 68.26 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.175 -0.92 . . . . 71.329999999999998 110.413 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -56.8 -41.98 78.68 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.468 0.651 . . . . 71.450000000000003 110.301 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.06 -13.32 62.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.902 -1.044 . . . . 73.129999999999995 112.189 -177.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -98.9 -7.95 26.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.987 0.422 . . . . 75.209999999999994 110.391 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.523 ' HG3' ' HB1' ' A' ' 45' ' ' ALA . 55.1 mtt -94.19 -50.77 5.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.221 -0.445 . . . . 74.019999999999996 111.08 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 0.0 OUTLIER -57.13 -25.8 59.45 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.49 -0.777 . . . . 72.219999999999999 111.968 -173.843 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.56 -42.57 92.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.055 -0.52 . . . . 64.019999999999996 110.448 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -82.36 -34.47 28.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 71.450000000000003 110.516 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.448 HG13 ' O ' ' B' ' 281' ' ' MET . 69.0 mt -58.22 -58.02 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 116.228 -0.442 . . . . 74.109999999999999 111.677 -177.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.0 pt-20 -64.49 -29.06 70.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.34 -0.391 . . . . 74.120000000000005 111.346 -175.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -100.04 12.45 36.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.721 -0.218 . . . . 64.530000000000001 111.342 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.561 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 78.3 t80 -55.31 -56.94 14.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.727 -0.215 . . . . 60.520000000000003 111.19 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 22.9 t70 . . . . . 0 C--N 1.328 -0.35 0 CA-C-O 120.82 0.343 . . . . 71.329999999999998 110.598 -176.836 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.7 p-10 . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 109.483 -0.562 . . . . 62.32 109.483 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -67.99 -83.4 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.438 . . . . 75.109999999999999 111.0 -176.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -111.9 -42.16 3.85 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.854 -0.612 . . . . 71.409999999999997 109.511 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.709 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -93.45 154.02 18.16 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.859 -0.61 . . . . 75.400000000000006 110.097 174.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.452 ' HB2' ' HD2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -78.36 51.91 1.08 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.602 -0.726 . . . . 74.109999999999999 112.478 -177.333 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -51.91 -46.95 64.81 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.847 0.356 . . . . 72.019999999999996 111.46 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.2 -6.07 36.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.913 -0.585 . . . . 75.430000000000007 112.359 -173.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 84.7 mtt180 -100.11 -60.71 1.48 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.926 -0.398 . . . . 73.230000000000004 109.926 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.27 -25.65 24.63 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.594 0.59 . . . . 52.530000000000001 112.594 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.9 t -62.13 -26.53 68.37 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.743 -0.208 . . . . 73.049999999999997 111.362 -178.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.565 ' HB2' HD11 ' B' ' 217' ' ' LEU . 26.5 mt-10 -84.39 -25.14 29.3 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.354 0.597 . . . . 75.25 109.705 -178.067 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.74 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -68.56 -49.53 58.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.31 -0.859 . . . . 71.5 109.203 177.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.525 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.2 mt -64.91 -29.28 46.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.643 -0.708 . . . . 71.340000000000003 109.807 175.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 12' ' ' THR . 2.4 tmmt? -62.5 -38.0 88.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.804 -0.634 . . . . 74.219999999999999 111.085 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.5 HD12 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -65.92 -47.42 74.83 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.873 -0.788 . . . . 54.039999999999999 108.873 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.59 -35.85 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.39 -0.823 . . . . 70.129999999999995 110.969 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.627 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 5.1 m-80 -58.94 -34.5 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 75.109999999999999 111.347 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.0 -41.58 67.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.242 -0.435 . . . . 72.230000000000004 111.271 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -74.11 -20.51 60.23 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.346 0.593 . . . . 73.140000000000001 109.909 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -83.51 -4.91 58.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.302 -0.863 . . . . 74.439999999999998 110.751 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.627 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 88.9 mt-30 -82.54 17.83 1.67 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.396 -0.365 . . . . 72.450000000000003 111.162 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.454 HD21 ' HA ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -105.33 156.96 17.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.759 0.314 . . . . 72.400000000000006 110.616 -177.338 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 t -100.63 -37.02 8.94 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.837 0.68 . . . . 72.439999999999998 112.837 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.8 pm0 -85.23 -2.44 58.05 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.752 -0.379 . . . . 72.420000000000002 110.951 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 28' ' ' GLN . 8.6 mt -96.91 145.44 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.526 0.679 . . . . 64.340000000000003 110.252 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.653 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 65.6 mt-30 -79.66 140.71 36.97 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.716 -1.129 . . . . 65.420000000000002 108.105 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.4 m -58.38 -24.83 61.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.987 0.422 . . . . 72.209999999999994 111.06 -176.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -82.17 -11.73 81.9 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.868 -0.605 . . . . 73.049999999999997 113.833 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.653 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 50.2 mt-10 -70.21 -31.31 68.68 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 117.97 0.885 . . . . 70.450000000000003 110.286 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 19.0 t -79.45 -32.76 14.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.642 -0.708 . . . . 64.109999999999999 109.901 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.66 -42.57 98.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.608 -0.723 . . . . 72.310000000000002 110.202 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.04 -36.22 81.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.624 -0.716 . . . . 73.540000000000006 111.177 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.452 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 3.6 p -71.96 -27.71 62.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.349999999999994 110.458 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.593 ' CD1' HD12 ' B' ' 214' ' ' LEU . 11.4 t80 -69.6 -37.57 76.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.415 -0.587 . . . . 72.209999999999994 109.415 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.751 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 12.1 ttt -72.73 -49.85 28.4 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.892 -0.595 . . . . 74.140000000000001 111.104 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -52.4 -41.66 63.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.497 -0.774 . . . . 75.549999999999997 110.831 174.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.542 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.97 -33.78 76.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 63.130000000000003 111.348 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.562 HD21 ' HG3' ' B' ' 237' ' ' MET . 58.3 tp -65.65 -35.64 81.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.024 0.44 . . . . 71.019999999999996 110.136 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.446 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -63.4 -44.26 95.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.783 -0.644 . . . . 72.400000000000006 110.715 178.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -67.21 -24.12 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.215 -0.448 . . . . 61.439999999999998 110.99 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.411 ' HD1' HG23 ' B' ' 215' ' ' ILE . 3.1 t80 -90.02 -47.43 7.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.29 -0.414 . . . . 65.120000000000005 110.836 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -65.44 -26.04 67.79 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.1 0.407 . . . . 73.129999999999995 112.1 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.43 -14.53 62.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.787 0.327 . . . . 65.219999999999999 111.259 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -61.58 -31.92 72.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 75.049999999999997 110.342 176.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.882 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 55.0 m-85 -70.65 -12.99 61.9 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.173 -0.467 . . . . 71.420000000000002 111.226 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.505 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -65.54 -32.63 83.91 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.22 -0.991 . . . . 52.340000000000003 110.643 173.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.903 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 15.3 m -78.23 -9.57 59.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.009 0.433 . . . . 30.52 110.857 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 63.2 p -106.71 -3.1 20.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.184 0.516 . . . . 55.310000000000002 110.324 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.1 t -72.84 -43.37 62.73 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.67 -0.696 . . . . 75.030000000000001 110.522 -175.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.47 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 11.0 m-85 -149.72 178.1 9.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.921 -0.582 . . . . 71.140000000000001 110.596 -177.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.6 pt-20 -98.61 -52.65 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.059 -0.519 . . . . 60.130000000000003 111.129 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.425 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.6 p -88.01 148.59 24.45 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 116.596 -0.275 . . . . 72.430000000000007 110.523 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.427 ' HB2' ' HE2' ' A' ' 55' ' ' LYS . 7.8 ptmm? -66.28 -25.34 66.82 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.869 -0.332 . . . . 75.109999999999999 110.62 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -64.59 -41.65 96.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.437 . . . . 71.510000000000005 110.613 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.725 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 91.3 mt-30 -85.93 -37.99 18.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.996 -0.547 . . . . 71.349999999999994 109.806 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.903 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.6 ttt -63.88 -43.43 96.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.586 -0.734 . . . . 63.329999999999998 111.618 -177.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.575 ' HA ' HD13 ' B' ' 285' ' ' ILE . 42.9 tt0 -68.86 -34.92 76.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.36 -0.382 . . . . 75.530000000000001 111.154 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.07 2.56 10.35 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.205 -0.452 . . . . 73.140000000000001 111.613 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.725 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.6 mmmt -113.52 -2.44 13.87 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 110.092 -0.336 . . . . 63.130000000000003 110.092 -177.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 0.2 OUTLIER -49.74 -57.9 6.38 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 123.721 0.638 . . . . 75.420000000000002 110.889 -175.319 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -80.07 -20.96 43.98 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 110.254 -0.276 . . . . 74.239999999999995 110.254 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -73.53 -39.61 64.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 63.420000000000002 111.866 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.5 ptt? -84.32 -19.12 34.24 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 119.9 -0.72 . . . . 60.299999999999997 109.483 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.402 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 46.0 mtp -85.35 -21.85 28.72 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.276 -0.874 . . . . 73.019999999999996 111.35 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.114 0.483 . . . . 53.299999999999997 111.072 -171.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.595 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.6 p90 -96.99 -8.12 31.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.863 -0.608 . . . . 75.239999999999995 111.073 -178.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.524 ' HD2' HD21 ' B' ' 277' ' ' LEU . 2.6 m-30 -61.4 -40.16 93.38 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 120.576 0.227 . . . . 72.349999999999994 111.009 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.617 ' SD ' ' HE3' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -55.69 -50.75 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.323 0.582 . . . . 73.109999999999999 110.224 174.795 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.539 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 1.9 t70 -88.02 27.45 1.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.238 -0.892 . . . . 71.200000000000003 111.467 -170.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 17.3 mmm180 -91.95 -54.45 3.85 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.17 -0.331 . . . . 61.439999999999998 111.317 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.748 ' HB3' ' HG2' ' B' ' 237' ' ' MET . 0.1 OUTLIER -79.33 5.62 12.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.181 0.515 . . . . 71.209999999999994 110.527 -177.372 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.74 -45.93 92.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.501 -0.772 . . . . 73.400000000000006 110.684 -179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.51 -33.11 74.96 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.726 -0.67 . . . . 72.349999999999994 111.097 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -69.2 -41.1 77.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.341 0.591 . . . . 64.530000000000001 109.951 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.49 ' HB3' ' CE ' ' B' ' 266' ' ' MET . 0.7 OUTLIER -65.36 -38.84 91.26 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.906 -1.043 . . . . 74.230000000000004 111.423 -174.539 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.445 ' N ' ' HE1' ' B' ' 266' ' ' MET . 28.8 t70 -65.21 -33.56 76.29 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.1 0.476 . . . . 52.119999999999997 110.795 -178.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.96 -14.84 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.895 -0.593 . . . . 73.349999999999994 110.753 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -92.22 -20.39 21.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.555 . . . . 71.439999999999998 110.383 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.44 ' C ' ' H ' ' A' ' 83' ' ' ASP . 24.0 mmt -77.2 -168.26 1.07 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.935 -0.575 . . . . 54.340000000000003 110.936 177.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 1.051 ' HA ' HD12 ' A' ' 85' ' ' ILE . 48.6 mt-10 66.98 -7.69 0.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.994 -1.003 . . . . 72.129999999999995 112.201 -178.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.468 ' O ' HG13 ' A' ' 85' ' ' ILE . 41.8 t0 -79.15 150.61 31.67 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.732 -0.84 . . . . 75.510000000000005 108.732 172.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.467 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 3.1 m-85 73.13 -40.92 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.589 1.155 . . . . 73.319999999999993 110.672 -172.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 1.051 HD12 ' HA ' ' A' ' 82' ' ' GLU . 7.4 mt -56.72 -57.63 8.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.269 -0.878 . . . . 73.319999999999993 111.131 177.524 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -57.75 -26.54 61.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.172 -0.922 . . . . 70.319999999999993 111.356 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 26.9 m120 -100.43 2.82 42.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.409999999999997 111.47 -175.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -58.72 -48.22 81.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 72.329999999999998 110.452 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.079 -0.51 . . . . 74.329999999999998 110.334 178.666 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 . . . . . 0 CA--C 1.521 -0.147 0 CA-C-O 120.917 0.389 . . . . 72.439999999999998 111.056 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.62 -86.51 0.15 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.997 -0.547 . . . . 63.149999999999999 110.321 173.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -111.6 -24.83 9.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.063 0.459 . . . . 62.119999999999997 110.546 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -94.76 -160.41 0.78 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.942 -0.572 . . . . 63.240000000000002 111.608 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.452 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -127.29 44.47 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.649 -0.705 . . . . 72.400000000000006 110.907 -176.575 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -52.89 -49.11 66.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.936 -0.575 . . . . 74.439999999999998 111.927 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.99 -25.57 63.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.82 -0.627 . . . . 65.329999999999998 112.027 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -82.64 -60.64 2.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 110.184 -0.302 . . . . 73.519999999999996 110.184 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.602 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -56.69 -27.29 58.6 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.872 0.693 . . . . 72.230000000000004 112.872 -176.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.1 t -68.59 -20.16 64.5 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.851 0.358 . . . . 73.230000000000004 110.976 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -80.81 -31.5 35.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.479 0.657 . . . . 75.150000000000006 109.283 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -66.4 -50.58 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.867 -1.06 . . . . 72.200000000000003 110.017 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.542 HG13 ' HB1' ' A' ' 39' ' ' ALA . 75.0 mt -63.82 -32.05 55.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.878 -0.601 . . . . 71.510000000000005 110.373 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -60.11 -34.09 73.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.462 -0.79 . . . . 71.439999999999998 110.985 -177.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.649 HD12 HD13 ' A' ' 14' ' ' LEU . 3.3 tm? -69.7 -40.42 76.34 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.288 -0.634 . . . . 64.310000000000002 109.288 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -63.06 -31.83 73.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.014 -0.539 . . . . 73.310000000000002 110.674 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.74 -31.62 72.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 73.230000000000004 110.76 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.11 -18.05 53.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.114 -0.494 . . . . 63.130000000000003 111.131 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 221' ' ' GLN . . . . . 0.408 ' OE1' HD21 ' A' ' 14' ' ' LEU . 70.5 mt-30 -92.38 -25.04 18.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.232 0.539 . . . . 62.509999999999998 110.021 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -79.14 4.46 14.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.753 -0.658 . . . . 65.239999999999995 109.968 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -73.47 -10.68 59.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.012 -0.736 . . . . 75.109999999999999 109.012 172.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -77.78 134.87 37.95 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.078 -0.964 . . . . 62.43 110.855 175.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.5 t -115.35 -15.63 11.54 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.397 -0.819 . . . . 73.040000000000006 108.823 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 226' ' ' GLU . . . . . 0.442 ' H ' ' CD ' ' B' ' 226' ' ' GLU . 1.6 pm0 -76.52 -22.76 53.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.969 -1.014 . . . . 75.510000000000005 110.423 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.406 HG22 ' N ' ' B' ' 228' ' ' GLN . 10.0 mt -98.29 156.37 3.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.269 -0.423 . . . . 73.319999999999993 109.941 177.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.546 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 73.4 mt-30 -76.01 138.88 41.19 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.519 -0.548 . . . . 74.400000000000006 109.519 174.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 26.9 m -60.14 -29.72 68.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.532 . . . . 64.310000000000002 110.436 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 230' ' ' GLY . . . . . 0.882 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -63.93 -26.8 70.45 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 115.62 -0.718 . . . . 43.32 113.048 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.546 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 34.5 mt-10 -72.8 -31.19 64.67 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 117.233 0.517 . . . . 72.549999999999997 110.468 -177.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 43.7 t -73.3 -36.9 50.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.355 0.597 . . . . 75.409999999999997 110.265 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 5.9 t -72.36 -37.75 68.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.957 -0.565 . . . . 54.299999999999997 109.73 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.36 -33.05 73.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.822 -0.627 . . . . 62.420000000000002 111.383 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 3.5 p -69.52 -28.79 66.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.795 0.331 . . . . 62.520000000000003 110.456 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.586 ' CD1' HD12 ' A' ' 14' ' ' LEU . 7.7 t80 -69.77 -37.07 76.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.536 0.684 . . . . 61.030000000000001 109.17 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.748 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 11.1 ttt -71.76 -52.91 15.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.451 -0.795 . . . . 62.109999999999999 111.251 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 14.1 t-105 -52.35 -39.9 61.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.49 -0.777 . . . . 75.010000000000005 111.061 175.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.525 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.43 -36.76 84.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 75.450000000000003 111.126 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 57.7 tp -65.82 -35.18 79.97 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.864 0.364 . . . . 64.340000000000003 110.33 179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.77 73.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 64.430000000000007 110.781 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -64.66 -33.59 76.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.099 -0.501 . . . . 72.140000000000001 110.84 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -74.36 -39.55 62.69 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.947 -0.569 . . . . 73.430000000000007 111.021 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.13 -24.1 51.69 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.936 0.347 . . . . 71.299999999999997 111.936 -178.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.403 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.19 -17.48 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 71.319999999999993 111.089 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -59.0 -38.11 78.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.851 -0.613 . . . . 73.310000000000002 110.251 175.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -75.81 3.22 10.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.625 -0.716 . . . . 73.140000000000001 111.82 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 248' ' ' GLY . . . . . 0.508 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -65.39 -35.01 90.88 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 119.983 -1.103 . . . . 72.439999999999998 110.438 171.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 249' ' ' SER . . . . . 0.923 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 78.9 p -77.66 -6.67 54.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.285 -0.458 . . . . 64.230000000000004 111.362 -177.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 62.4 p -109.38 -1.94 18.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.085 0.469 . . . . 70.140000000000001 110.408 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 24.0 t -81.44 -39.8 24.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.721 -0.672 . . . . 72.530000000000001 110.771 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.68 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 1.7 m-85 -145.13 178.71 7.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.132 0.492 . . . . 73.430000000000007 112.075 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.471 ' HG3' HG23 ' B' ' 254' ' ' THR . 13.5 pt-20 -104.5 -43.91 5.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.269 -0.878 . . . . 74.230000000000004 111.516 -172.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.471 HG23 ' HG3' ' B' ' 253' ' ' GLU . 45.7 p -104.77 149.4 25.66 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 116.523 -0.308 . . . . 64.409999999999997 110.287 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.418 ' HB2' ' HE2' ' B' ' 255' ' ' LYS . 10.5 ptmm? -69.62 -26.83 64.62 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.846 0.355 . . . . 73.109999999999999 110.218 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -53.01 -51.35 61.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.64 -0.709 . . . . 71.530000000000001 110.579 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.599 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 92.3 mt-30 -83.7 -46.69 12.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.561 -0.745 . . . . 71.140000000000001 110.344 -178.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.923 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.6 ttt -56.35 -41.74 76.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.458 -0.792 . . . . 63.450000000000003 111.829 -175.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.63 ' HB2' HG21 ' A' ' 85' ' ' ILE . 28.7 tt0 -69.59 -36.41 76.2 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.673 0.273 . . . . 71.540000000000006 110.989 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.68 -6.22 51.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.345 0.593 . . . . 55.420000000000002 110.495 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.68 ' HE3' ' CE2' ' B' ' 252' ' ' PHE . 70.6 mmtt -99.03 -2.33 37.48 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.531 -0.759 . . . . 71.150000000000006 110.944 -177.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.699 ' HG3' ' H ' ' B' ' 263' ' ' GLN . 11.6 ptpt -50.73 -50.77 54.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.853 -0.612 . . . . 71.200000000000003 110.546 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.699 ' H ' ' HG3' ' B' ' 262' ' ' LYS . 12.5 tp60 -79.47 -22.14 44.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 116.145 -0.48 . . . . 72.040000000000006 110.533 -176.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.55 -30.8 37.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.239 -0.437 . . . . 55.049999999999997 111.408 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.508 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 24.0 ptp -83.75 -31.49 25.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.648 -0.871 . . . . 70.209999999999994 108.648 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.49 ' CE ' ' HB3' ' A' ' 77' ' ' LEU . 59.2 mtp -82.64 -3.37 56.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.259 -0.882 . . . . 64.420000000000002 110.442 176.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.44 -42.73 98.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.132 -0.486 . . . . 74.25 110.629 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.662 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 21.0 p90 -105.63 -9.04 17.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.865 -0.607 . . . . 70.120000000000005 111.079 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 3.5 m-30 -55.41 -51.13 67.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 O-C-N 123.074 0.233 . . . . 72.420000000000002 110.785 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.545 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -50.44 -58.5 5.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.893 -0.594 . . . . 74.010000000000005 110.74 176.73 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 271' ' ' ASP . . . . . 0.471 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 19.6 t70 -87.2 63.69 7.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.658 -0.701 . . . . 72.420000000000002 111.108 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 4.9 mmp_? -121.97 -45.66 2.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.111 -0.495 . . . . 64.340000000000003 111.284 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.751 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -92.03 13.28 19.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.3 . . . . 74.040000000000006 110.515 -174.769 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.617 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.0 ttmt -59.3 -54.31 48.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 53.109999999999999 110.84 -178.341 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -59.97 -41.56 92.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.397 -0.365 . . . . 64.519999999999996 111.41 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.18 -47.97 83.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.385 0.612 . . . . 71.239999999999995 109.963 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.574 HD23 ' HE1' ' A' ' 70' ' ' MET . 41.5 tp -63.18 -36.65 84.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.875 -1.057 . . . . 74.5 110.504 -178.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 278' ' ' ASP . . . . . 0.402 ' N ' ' HE1' ' A' ' 66' ' ' MET . 9.1 t70 -63.71 -42.08 98.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.73 -0.668 . . . . 70.140000000000001 110.458 177.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -76.33 -14.99 60.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.649 -0.705 . . . . 42.210000000000001 111.324 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -94.85 -2.82 50.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.061 0.457 . . . . 74.239999999999995 110.72 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 19.0 mmt -89.49 179.77 5.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.883 -0.599 . . . . 73.439999999999998 110.684 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.704 ' HG2' HD12 ' B' ' 285' ' ' ILE . 42.1 mt-10 69.2 7.13 6.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.292 1.219 . . . . 63.450000000000003 114.292 166.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -64.78 -51.35 62.69 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.969 0.414 . . . . 72.329999999999998 110.297 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -77.14 -23.61 51.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.262 -0.426 . . . . 75.340000000000003 110.477 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.704 HD12 ' HG2' ' B' ' 282' ' ' GLU . 68.5 mt -65.19 -53.19 43.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.936 -0.574 . . . . 70.349999999999994 110.862 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 11.3 pt-20 -67.49 -20.96 65.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.109999999999999 111.78 -178.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 287' ' ' ASN . . . . . 0.421 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 51.5 m-80 -106.54 5.59 29.3 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.778 0.288 . . . . 71.439999999999998 111.778 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.88 -47.42 80.5 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.116 -0.234 . . . . 62.020000000000003 111.187 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 116.149 -0.478 . . . . 71.099999999999994 111.013 -178.707 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.0 p-10 . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 109.018 -0.734 . . . . 74.340000000000003 109.018 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -78.79 -80.27 0.12 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.173 -0.467 . . . . 62.43 112.011 -171.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -98.78 -21.31 16.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.356 0.598 . . . . 60.020000000000003 110.768 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.68 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -133.16 -179.75 5.69 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.792 -0.64 . . . . 61.020000000000003 111.46 -173.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -83.67 46.13 1.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.334 -0.848 . . . . 65.030000000000001 111.871 -176.878 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -55.42 -41.13 72.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.772 0.32 . . . . 65.010000000000005 111.55 -176.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.39 -13.41 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 54.350000000000001 111.878 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 41.4 mmt180 -93.32 -60.34 1.81 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.765 -0.198 . . . . 73.040000000000006 110.627 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.789 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.31 -22.44 12.02 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.805 0.669 . . . . 73.120000000000005 112.805 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.592 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.7 t -68.37 -22.41 64.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.678 0.275 . . . . 71.25 110.768 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HB2' HD11 ' B' ' 217' ' ' LEU . 41.3 mt-10 -81.04 -27.61 35.69 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.319 0.58 . . . . 74.430000000000007 109.631 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.789 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -70.36 -48.53 55.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.205 -0.907 . . . . 72.109999999999999 109.724 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.459 HG13 ' HB1' ' B' ' 239' ' ' ALA . 80.6 mt -66.53 -27.86 41.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.469 0.652 . . . . 64.329999999999998 109.91 175.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.592 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.1 OUTLIER -66.74 -29.07 68.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.448 -0.796 . . . . 64.140000000000001 110.743 -177.362 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.663 HD12 HD13 ' B' ' 214' ' ' LEU . 2.8 tm? -75.25 -36.67 61.25 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.329 -0.619 . . . . 71.450000000000003 109.329 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.16 -28.45 70.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.801 -0.636 . . . . 64.409999999999997 110.462 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -76.9 -19.27 57.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.941 -0.572 . . . . 72.219999999999999 110.263 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -73.02 -41.82 63.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.68 -0.691 . . . . 71.409999999999997 109.474 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -78.93 -19.88 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.31 -0.859 . . . . 70.030000000000001 110.034 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -78.41 -5.86 53.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.663 -0.699 . . . . 44.240000000000002 110.128 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -75.55 -9.77 58.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.24 -0.436 . . . . 74.200000000000003 110.607 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.64 111.48 14.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 72.439999999999998 109.726 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 25' ' ' THR . 2.9 t -73.37 -27.28 61.39 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.809 -0.632 . . . . 61.450000000000003 112.018 -174.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.26 -3.39 59.04 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.494 0.553 . . . . 64.219999999999999 112.494 -177.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.1 mt -107.45 149.51 10.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.806 -0.442 . . . . 65.530000000000001 109.806 177.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.08 145.06 32.63 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.16 -0.681 . . . . 72.099999999999994 109.16 177.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.491 HG22 ' HZ ' ' B' ' 247' ' ' PHE . 6.6 m -60.35 -25.11 65.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.203 0.525 . . . . 63.329999999999998 110.382 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.66 -15.74 71.3 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.691 -0.686 . . . . 73.209999999999994 112.884 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -81.28 -31.94 33.45 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.367 -0.605 . . . . 74.239999999999995 109.367 176.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -72.36 -44.78 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.467 -0.788 . . . . 63.039999999999999 110.443 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.0 p -60.91 -39.37 89.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.181 0.515 . . . . 64.209999999999994 110.471 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.56 72.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 74.310000000000002 110.788 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.414 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 51.6 m -67.96 -37.27 81.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.769 0.318 . . . . 75.310000000000002 110.159 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.566 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.1 t80 -68.24 -36.18 79.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.105 -0.702 . . . . 61.229999999999997 109.105 175.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.591 ' SD ' HD21 ' B' ' 240' ' ' LEU . 10.3 tpt -60.18 -60.75 3.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.919 -1.037 . . . . 73.219999999999999 110.974 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.486 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 30.7 t-105 -59.52 -33.68 71.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.477 -0.783 . . . . 64.349999999999994 111.428 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.401 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.0 -41.52 90.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 61.420000000000002 111.586 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.59 HD13 ' HB3' ' B' ' 236' ' ' PHE . 50.3 tp -67.35 -33.1 74.53 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.983 0.42 . . . . 74.540000000000006 110.482 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -62.2 -40.12 95.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 22.120000000000001 110.839 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 42' ' ' ARG . 38.2 mtp85 -74.74 -34.8 62.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.804 -0.634 . . . . 72.120000000000005 110.823 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.518 ' HD2' HG23 ' B' ' 215' ' ' ILE . 9.9 t80 -76.53 -35.38 58.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 74.450000000000003 110.739 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -75.1 -34.95 61.78 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 111.807 0.299 . . . . 74.340000000000003 111.807 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.521 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -68.47 -14.87 63.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.974 0.416 . . . . 75.5 111.361 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -58.11 -32.72 68.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.764 -0.653 . . . . 72.439999999999998 110.323 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.574 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 78.1 m-85 -80.38 -7.74 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.902 -0.59 . . . . 34.310000000000002 111.917 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.431 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -58.89 -34.93 80.47 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.452 -0.88 . . . . 64.400000000000006 111.779 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.1 t -72.79 -19.55 61.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.734 0.302 . . . . 71.510000000000005 111.087 -178.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 p -89.72 -14.21 35.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.783 0.325 . . . . 73.400000000000006 110.877 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.1 m -70.91 -32.49 69.44 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.258 -0.428 . . . . 75.150000000000006 111.951 -174.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -179.15 7.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.116 0.484 . . . . 62.219999999999999 111.537 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -99.77 -47.98 4.87 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.083 -0.962 . . . . 75.409999999999997 111.097 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.2 p -99.7 159.1 15.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.691 -0.231 . . . . 75.530000000000001 110.596 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -68.1 -34.95 77.35 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.083 0.24 . . . . 72.129999999999995 111.14 -175.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.31 -47.49 82.02 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.972 0.415 . . . . 73.319999999999993 110.53 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.594 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 95.4 mt-30 -75.43 -32.73 60.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 54.340000000000003 110.314 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.1 ttt -66.26 -45.7 79.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.021 -0.536 . . . . 73.549999999999997 110.782 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.49 ' HB2' HG21 ' B' ' 285' ' ' ILE . 34.0 tt0 -67.15 -29.82 69.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.815 -0.63 . . . . 73.120000000000005 110.753 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.84 -4.11 26.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.379 -0.373 . . . . 60.119999999999997 111.692 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.594 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.3 mmmm -117.67 4.66 12.32 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 120.75 0.31 . . . . 64.5 110.491 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 16.3 ptmt -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.9 -0.591 . . . . 72.329999999999998 110.736 -174.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.411 HE22 ' HE2' ' B' ' 274' ' ' LYS . 16.4 tp60 -68.75 -26.08 65.06 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.87 0.367 . . . . 75.120000000000005 110.559 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.76 -42.97 69.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.974 -0.557 . . . . 65.510000000000005 111.644 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.546 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.8 ptt? -83.75 -27.08 29.15 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.17 -0.612 . . . . 63.299999999999997 109.782 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.641 ' HG2' HD22 ' B' ' 277' ' ' LEU . 75.7 mtp -78.47 -17.79 55.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.628 -0.715 . . . . 75.420000000000002 111.575 -178.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.44 -24.75 66.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.525 -0.917 . . . . 73.299999999999997 108.525 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.536 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 34.7 m-85 -93.71 -32.96 13.82 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 114.414 -1.266 . . . . 74.010000000000005 111.199 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.434 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 23.1 m-85 -60.98 -45.13 96.01 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.204 -0.665 . . . . 71.049999999999997 109.204 175.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.48 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -67.04 -59.83 3.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.375 -0.375 . . . . 72.310000000000002 110.039 169.963 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -106.34 81.54 1.62 Allowed 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 113.189 0.811 . . . . 74.329999999999998 113.189 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.536 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 7.9 mmm180 -147.13 -31.16 0.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.731 -0.668 . . . . 72.230000000000004 109.757 164.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.629 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -93.08 10.87 29.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.309 -0.626 . . . . 71.319999999999993 109.309 178.148 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -66.36 -56.32 11.67 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.271 -0.877 . . . . 55.229999999999997 110.076 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.62 -36.81 77.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.477 -0.329 . . . . 64.409999999999997 110.925 177.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.0 mtt -62.67 -41.08 98.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.238 0.542 . . . . 74.010000000000005 110.05 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.547 HD22 ' HG2' ' B' ' 266' ' ' MET . 1.2 tt -71.89 -42.11 67.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.486 -0.779 . . . . 43.310000000000002 110.144 -176.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.74 -39.85 82.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.26 0.553 . . . . 54.210000000000001 109.948 175.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.45 -21.22 66.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.324 -0.853 . . . . 72.129999999999995 111.365 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -93.36 -24.04 18.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 70.439999999999998 110.25 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.406 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 25.4 mmt -63.2 -45.59 91.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.523 -0.917 . . . . 71.329999999999998 108.523 169.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 43.4 mm-40 -68.21 12.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.24 -0.891 . . . . 75.230000000000004 111.916 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -93.01 -55.5 3.32 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.902 -0.777 . . . . 54.420000000000002 108.902 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.785 -0.643 . . . . 71.340000000000003 111.808 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.7 mt -62.3 -57.39 12.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.491 0.186 . . . . 73.030000000000001 111.433 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.7 pt-20 -69.18 -15.74 63.47 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.125 0.417 . . . . 42.210000000000001 112.125 -175.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -109.13 10.3 25.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.998 -0.281 . . . . 75.120000000000005 110.942 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.516 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 71.5 t80 -57.87 -47.93 81.3 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.451 -0.34 . . . . 72.299999999999997 111.106 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.5 t70 . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 116.384 -0.371 . . . . 65.030000000000001 110.443 -177.011 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.757 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.822 -0.436 . . . . 73.420000000000002 109.822 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -91.05 -75.85 0.46 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.095 -0.706 . . . . 52.32 109.095 178.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -115.5 -37.38 4.02 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.52 -0.919 . . . . 73.150000000000006 108.52 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.757 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -93.99 150.97 19.88 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.162 -0.926 . . . . 73.049999999999997 111.764 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.468 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -71.68 57.89 0.3 Allowed 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 125.064 1.346 . . . . 63.32 113.146 -179.639 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -51.67 -43.06 62.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.479 0.548 . . . . 71.219999999999999 112.479 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.25 -27.76 69.23 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.946 0.721 . . . . 74.349999999999994 112.946 -174.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.425 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 19.5 mmt180 -87.66 -56.49 3.33 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.939 -0.304 . . . . 62.409999999999997 111.642 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.601 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -51.75 -25.73 8.1 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.689 0.626 . . . . 73.129999999999995 112.689 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 212' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 6.2 t -69.32 -23.63 63.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 121.336 -0.146 . . . . 52.340000000000003 111.357 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -81.71 -27.87 33.7 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.1 -0.704 . . . . 72.310000000000002 109.1 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.663 HD13 HD12 ' A' ' 17' ' ' LEU . 3.4 mm? -67.08 -51.78 50.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.78 -1.1 . . . . 73.310000000000002 109.467 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.518 HG23 ' HD2' ' A' ' 43' ' ' TYR . 78.1 mt -63.67 -30.37 49.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.515 -0.766 . . . . 75.540000000000006 110.227 176.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.497 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.0 OUTLIER -59.62 -36.98 77.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.8 -0.636 . . . . 70.230000000000004 110.82 -177.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.603 ' HA ' ' NE2' ' B' ' 220' ' ' GLN . 3.0 tm? -67.61 -40.01 84.74 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.128 -0.693 . . . . 71.400000000000006 109.128 178.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.16 66.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.716 -0.675 . . . . 72.349999999999994 110.707 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.562 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 5.2 m-20 -66.28 -42.06 88.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.781 -0.645 . . . . 74.150000000000006 110.488 176.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 220' ' ' GLN . . . . . 0.603 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -61.78 -43.85 98.04 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.834 0.349 . . . . 74.430000000000007 111.158 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -70.16 -21.6 63.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.201 0.524 . . . . 73.209999999999994 110.379 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -79.51 -13.38 59.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.687 -0.688 . . . . 74.540000000000006 109.891 177.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.562 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 20.3 mm-40 -83.77 -2.07 55.55 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.318 -0.401 . . . . 74.510000000000005 110.218 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.425 ' HB3' HG13 ' B' ' 227' ' ' ILE . 0.9 OUTLIER -81.46 103.26 11.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.114 -0.698 . . . . 71.230000000000004 109.114 178.96 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.1 t -59.25 -28.77 67.01 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 113.412 0.893 . . . . 74.040000000000006 113.412 -171.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -87.22 -0.29 56.48 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.931 0.345 . . . . 74.329999999999998 111.931 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.425 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.7 mt -112.24 149.49 14.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.866 -0.42 . . . . 64.549999999999997 109.866 177.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.471 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 0.3 OUTLIER -88.81 151.41 22.4 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.308 -0.627 . . . . 74.040000000000006 109.308 178.723 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.8 m -57.51 -30.83 65.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.262 0.554 . . . . 64.209999999999994 110.202 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 230' ' ' GLY . . . . . 0.574 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.8 -16.14 74.22 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.461 -0.79 . . . . 71.450000000000003 113.645 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.471 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 7.7 mm-40 -87.79 -24.98 23.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.552 0.676 . . . . 64.540000000000006 109.642 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.13 -40.4 44.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 73.030000000000001 110.242 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.7 p -63.15 -39.04 93.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.202 0.525 . . . . 72.140000000000001 110.271 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.9 -32.99 74.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.751 -0.659 . . . . 64.329999999999998 110.837 178.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 46.8 m -66.73 -37.37 84.53 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.105 0.478 . . . . 61.020000000000003 110.101 178.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.59 ' HB3' HD13 ' A' ' 40' ' ' LEU . 4.4 t80 -67.76 -35.67 79.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 73.340000000000003 109.696 177.21 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.629 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.3 ttm -67.06 -50.26 62.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.685 -0.689 . . . . 51.109999999999999 111.489 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -59.49 -38.79 81.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.073 0.463 . . . . 63.439999999999998 110.728 178.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.459 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.09 -41.07 91.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.01 -0.541 . . . . 74.439999999999998 111.443 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.591 HD21 ' SD ' ' A' ' 37' ' ' MET . 53.1 tp -65.67 -33.71 76.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.893 0.378 . . . . 55.210000000000001 110.557 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.2 -40.53 97.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 55.25 110.773 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.8 mtp85 -70.7 -42.15 71.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.061 -0.518 . . . . 72.310000000000002 110.604 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -70.6 -37.96 73.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.79 -0.641 . . . . 72.409999999999997 111.179 -174.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -71.83 -34.79 69.6 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.964 0.357 . . . . 52.299999999999997 111.964 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -65.74 -25.69 67.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 64.5 111.153 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -59.56 -33.84 71.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.637 -0.71 . . . . 74.329999999999998 110.113 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.491 ' HZ ' HG22 ' A' ' 29' ' ' THR . 71.5 m-85 -83.68 -8.71 59.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.31 -0.405 . . . . 73.209999999999994 111.33 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 248' ' ' GLY . . . . . 0.515 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -73.56 -30.94 61.38 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.23 -0.986 . . . . 64.239999999999995 110.661 171.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 34.9 t -70.12 -12.25 61.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.299 -0.451 . . . . 62.240000000000002 111.141 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.1 t -113.61 14.07 18.82 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.041 0.448 . . . . 72.109999999999999 110.27 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 29.0 t -88.95 -35.65 16.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.163 -0.472 . . . . 71.010000000000005 110.641 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.507 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.5 OUTLIER -137.95 174.01 11.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.761 0.315 . . . . 75.019999999999996 111.579 178.895 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -92.87 -30.61 15.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.773 -0.649 . . . . 72.430000000000007 112.325 -170.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.2 p -120.58 156.12 32.27 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.811 -0.177 . . . . 65.430000000000007 110.63 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.516 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 12.6 ptmm? -64.33 -29.11 70.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 72.530000000000001 110.37 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 256' ' ' GLU . . . . . 0.49 ' OE2' ' HG3' ' B' ' 255' ' ' LYS . 19.9 mm-40 -63.4 -57.58 9.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 75.430000000000007 110.651 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.697 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 97.5 mt-30 -68.94 -39.09 79.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.968 -0.56 . . . . 74.409999999999997 110.651 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.41 -44.08 96.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.285 -0.416 . . . . 75.099999999999994 110.883 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 54.3 tt0 -62.79 -35.78 80.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.089 0.471 . . . . 74.549999999999997 110.835 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -74.07 -5.81 43.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.006 -0.543 . . . . 64.230000000000004 111.094 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.697 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 14.3 mmmm -114.3 6.79 16.24 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.509 -0.314 . . . . 74.239999999999995 110.448 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.569 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 17.8 ptpt -56.95 -53.2 60.75 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 120.678 -0.409 . . . . 70.430000000000007 110.226 -177.074 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.556 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 15.0 tp60 -72.45 -22.01 61.15 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.847 -0.427 . . . . 72.140000000000001 109.847 -177.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -69.91 -42.44 73.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.6 -0.727 . . . . 65.400000000000006 111.299 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.569 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.6 ptt? -88.13 -27.7 21.74 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.211 0.529 . . . . 73.099999999999994 109.97 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.547 ' HG2' HD22 ' A' ' 77' ' ' LEU . 80.6 mtp -74.58 -17.51 60.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.684 -0.689 . . . . 75.340000000000003 110.611 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -62.37 -30.12 70.96 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.92 -0.77 . . . . 73.349999999999994 108.92 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.567 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.7 m-85 -86.7 -35.38 19.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.483 -1.235 . . . . 55.450000000000003 111.157 178.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.53 ' HA ' ' HE1' ' A' ' 37' ' ' MET . 22.6 m-30 -61.09 -44.29 97.59 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.485 -0.561 . . . . 73.230000000000004 109.485 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.431 ' N ' ' HE3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.55 -57.3 5.38 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.352 -0.539 . . . . 73.010000000000005 109.679 171.256 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 271' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 7.0 t70 -108.53 81.42 1.47 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.657 0.614 . . . . 74.230000000000004 112.657 -172.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.567 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 5.8 mmm180 -156.81 -26.81 0.09 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.945 -0.57 . . . . 73.150000000000006 110.029 166.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.405 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -95.27 9.32 40.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.469 -0.937 . . . . 74.540000000000006 108.469 174.191 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.437 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 62.1 tttm -64.29 -59.32 4.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.248 -1.342 . . . . 61.210000000000001 110.356 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -55.3 -38.86 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 54.530000000000001 111.013 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 276' ' ' MET . . . . . 0.486 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 50.2 mtt -60.63 -40.99 93.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.447 0.641 . . . . 73.430000000000007 110.412 177.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.641 HD22 ' HG2' ' A' ' 66' ' ' MET . 0.9 OUTLIER -75.01 -41.34 59.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.283 -0.871 . . . . 74.430000000000007 110.274 -178.006 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -57.87 -44.53 86.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 74.010000000000005 110.242 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.47 69.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.127 -0.942 . . . . 44.229999999999997 111.748 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -83.57 -21.49 32.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.9 0.381 . . . . 74.400000000000006 110.528 -178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.521 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 24.3 mmt -68.26 -52.97 27.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.038 -0.528 . . . . 72.430000000000007 110.14 175.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.688 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 40.1 mm-40 -51.08 -37.56 46.43 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.319 -0.855 . . . . 73.099999999999994 112.338 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -50.0 -42.75 49.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.697 0.284 . . . . 62.130000000000003 111.676 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -86.86 -32.16 20.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.857 0.36 . . . . 74.010000000000005 110.595 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.49 HG21 ' HB2' ' A' ' 59' ' ' GLN . 70.5 mt -66.28 -55.31 19.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.935 -0.575 . . . . 74.140000000000001 111.521 -177.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.688 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -75.08 -6.58 50.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 72.430000000000007 111.758 -175.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -116.37 12.37 15.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.328 -0.396 . . . . 75.530000000000001 110.857 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -53.0 -49.23 66.61 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.192 0.307 . . . . 71.329999999999998 111.037 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.862 -0.608 . . . . 72.109999999999999 111.134 179.341 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.5 p-10 . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 109.612 -0.514 . . . . 75.340000000000003 109.612 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -81.77 -81.66 0.14 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.762 0.315 . . . . 71.299999999999997 110.967 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -111.16 -33.13 6.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.899 0.381 . . . . 72.239999999999995 110.875 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.46 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -104.76 159.64 15.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.081 0.467 . . . . 72.519999999999996 111.363 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.1 OUTLIER -76.78 53.66 0.93 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.164 -0.925 . . . . 74.540000000000006 112.481 -177.531 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.425 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 37.8 m-85 -54.39 -38.99 66.81 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.862 0.363 . . . . 71.109999999999999 111.253 -178.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.44 -14.36 60.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.814 -0.63 . . . . 74.310000000000002 112.207 -176.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.616 ' NH1' ' HB3' ' B' ' 231' ' ' GLU . 64.5 mtt180 -93.5 -59.98 1.88 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.051 -0.352 . . . . 74.430000000000007 110.051 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.511 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.83 -25.94 21.92 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.766 -0.652 . . . . 60.409999999999997 112.657 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.5 t -63.95 -22.9 67.13 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.634 0.254 . . . . 61.229999999999997 111.296 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.546 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.9 mt-10 -90.98 -32.25 16.02 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.913 0.387 . . . . 74.349999999999994 109.969 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.614 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.6 mm? -61.92 -45.96 91.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.157 -0.683 . . . . 63.240000000000002 109.157 176.455 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.598 HG23 ' HD2' ' B' ' 243' ' ' TYR . 92.3 mt -66.86 -28.42 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.404 -0.817 . . . . 64.310000000000002 110.399 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.2 OUTLIER -68.49 -29.91 68.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.857 -0.61 . . . . 70.439999999999998 110.575 -177.101 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.489 HD12 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -69.86 -44.63 69.45 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.69 -0.856 . . . . 75.230000000000004 108.69 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.85 -33.1 74.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.374 -0.83 . . . . 64.439999999999998 109.965 178.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 5.4 t-20 -57.23 -38.7 74.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.221 -0.9 . . . . 52.149999999999999 110.396 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -67.01 -42.17 85.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 63.210000000000001 111.368 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -74.26 -20.32 60.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.053 0.454 . . . . 74.140000000000001 110.53 -177.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -88.04 0.21 56.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 55.240000000000002 110.68 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.9 mm-40 -80.77 55.23 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.868 0.366 . . . . 62.420000000000002 110.467 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -144.62 142.48 30.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 51.530000000000001 109.873 -177.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.5 t -93.18 -43.36 8.89 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.291 0.478 . . . . 53.119999999999997 112.291 -176.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -73.7 -24.75 59.98 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.382 0.512 . . . . 75.450000000000003 112.382 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 5.6 mt -83.76 143.98 10.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.296 -0.631 . . . . 71.430000000000007 109.296 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.655 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -83.42 150.68 25.9 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.997 -0.547 . . . . 53.530000000000001 110.017 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 m -56.37 -33.28 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.657 -0.702 . . . . 73.019999999999996 111.375 -175.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.586 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -63.14 -26.53 69.33 Favored Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.945 -0.57 . . . . 42.439999999999998 113.997 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.655 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 51.8 mm-40 -62.97 -28.43 70.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 117.318 0.559 . . . . 72.400000000000006 111.172 -176.001 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.67 -46.78 15.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 73.510000000000005 110.825 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 m -55.7 -40.11 71.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 63.130000000000003 110.983 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.78 68.37 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.14 -0.482 . . . . 64.299999999999997 111.229 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.5 m -66.9 -32.08 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 74.420000000000002 110.107 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.614 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.5 t80 -68.45 -33.11 73.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.872 -0.604 . . . . 74.409999999999997 109.854 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.568 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.5 ttm -68.09 -49.72 59.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 74.510000000000005 111.407 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.477 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 29.3 t-105 -62.02 -37.59 85.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.076 0.465 . . . . 73.25 110.669 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.42 -34.32 76.98 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 54.340000000000003 111.264 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.4 tp -65.64 -35.71 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 120.942 0.401 . . . . 74.230000000000004 110.029 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.524 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -62.11 -54.18 44.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.876 -0.602 . . . . 73.040000000000006 110.985 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -61.9 -32.82 73.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.644 -0.253 . . . . 74.099999999999994 111.602 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.403 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 11.1 t80 -77.4 -39.33 47.49 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.972 -0.291 . . . . 72.409999999999997 110.917 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -70.31 -35.41 73.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 75.150000000000006 110.806 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -69.54 -11.53 60.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.488 . . . . 73.239999999999995 111.129 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.403 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 19.2 t90 -74.19 -15.28 61.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.444 0.64 . . . . 73.099999999999994 109.833 176.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -97.8 -0.93 44.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.998 0.428 . . . . 75.200000000000003 111.142 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -74.94 -29.84 60.26 Favored Glycine 0 N--CA 1.443 -0.841 0 C-N-CA 120.47 -0.872 . . . . 74.439999999999998 111.009 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' SER . . . . . 1.024 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 7.0 p -73.15 -5.37 38.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.754 0.311 . . . . 73.299999999999997 111.826 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -120.19 14.01 12.11 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.428 . . . . 63.020000000000003 110.372 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -76.66 -54.93 5.99 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.163 -0.471 . . . . 54.039999999999999 111.884 -178.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.687 ' HE2' ' HE2' ' A' ' 61' ' ' LYS . 3.0 m-85 -128.87 173.55 10.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.034 0.445 . . . . 74.109999999999999 112.076 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.517 ' HG3' HG23 ' A' ' 54' ' ' THR . 12.1 pt-20 -88.51 -36.08 16.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.28 -0.873 . . . . 73.450000000000003 111.459 -172.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.517 HG23 ' HG3' ' A' ' 53' ' ' GLU . 62.9 p -119.85 151.53 38.72 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 116.105 -0.498 . . . . 74.540000000000006 110.283 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.577 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 21.2 ptmt -68.6 -25.07 64.68 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.652 -0.499 . . . . 54.229999999999997 109.652 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -55.2 -40.39 70.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.579 -0.737 . . . . 71.530000000000001 110.468 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.681 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 86.0 mt-30 -93.84 -43.32 8.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.623 -0.717 . . . . 64.030000000000001 110.311 178.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . 1.024 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.5 ttt -58.11 -40.64 81.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.642 -0.708 . . . . 71.120000000000005 111.904 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.738 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.8 tt0 -64.38 -41.92 96.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.814 0.34 . . . . 54.130000000000003 110.633 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.56 -18.29 64.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.097 -0.502 . . . . 64.439999999999998 111.164 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.687 ' HE2' ' HE2' ' A' ' 52' ' ' PHE . 32.3 mmmt -91.28 0.35 57.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.11 -0.495 . . . . 70.019999999999996 110.54 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HG2' ' N ' ' A' ' 63' ' ' GLN . 1.5 ptmm? -55.15 -43.05 73.88 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.829 -0.434 . . . . 64.230000000000004 109.829 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.41 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 11.1 tp60 -82.76 -19.61 37.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.278 -0.419 . . . . 64.450000000000003 110.521 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.17 -30.5 20.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.028 -0.533 . . . . 73.099999999999994 111.584 -175.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.3 ptp -82.02 -27.52 33.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.189 -1.041 . . . . 73.239999999999995 108.189 177.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.8 mtp -85.97 -10.02 55.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.899 -1.046 . . . . 73.120000000000005 110.429 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -53.05 -43.55 66.72 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.724 -0.671 . . . . 72.5 111.791 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.57 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 6.6 p90 -109.69 -1.53 17.98 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.159 -0.473 . . . . 73.349999999999994 111.215 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.677 ' HD2' HD21 ' B' ' 277' ' ' LEU . 4.2 m-30 -63.0 -46.99 85.04 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.52 0.2 . . . . 73.530000000000001 110.759 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.478 ' HE1' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.1 -46.22 72.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.415 0.626 . . . . 65.030000000000001 110.042 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -89.65 14.07 12.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.089 -0.959 . . . . 75.409999999999997 112.172 -168.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.736 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -86.08 -43.05 13.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.584 -0.697 . . . . 73.319999999999993 111.443 -172.065 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.685 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -98.68 15.29 25.68 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.389 -0.524 . . . . 55.539999999999999 110.212 -178.347 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.589 ' HE3' ' HG2' ' B' ' 270' ' ' MET . 32.8 ttmt -62.86 -52.92 61.26 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.705 -0.68 . . . . 72.129999999999995 109.576 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 75' ' ' GLU . 6.4 pt-20 -57.49 -41.41 80.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.137 -0.938 . . . . 73.400000000000006 111.135 177.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -61.16 -47.32 86.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.262 0.554 . . . . 73.200000000000003 110.592 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.591 HD13 ' HE1' ' B' ' 270' ' ' MET . 1.0 OUTLIER -69.66 -36.09 75.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.245 -0.889 . . . . 72.430000000000007 110.63 -174.551 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.46 ' N ' ' HE1' ' B' ' 266' ' ' MET . 19.2 t70 -61.12 -31.2 70.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.237 0.542 . . . . 51.219999999999999 110.532 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.9 59.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.602 -0.726 . . . . 72.340000000000003 111.524 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -105.46 -16.57 14.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.057 0.456 . . . . 75.409999999999997 110.662 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.446 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 20.9 mmt -75.97 -179.15 4.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.797 -0.638 . . . . 73.239999999999995 111.415 177.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.603 ' HA ' ' CG1' ' A' ' 85' ' ' ILE . 40.5 mt-10 67.8 8.74 6.63 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.878 -1.055 . . . . 64.010000000000005 113.718 171.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.29 -55.26 35.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.145 0.497 . . . . 74.129999999999995 110.648 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -85.24 -10.23 56.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.95 -0.568 . . . . 70.439999999999998 111.012 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.603 ' CG1' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -76.0 -57.33 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 120.757 0.313 . . . . 74.430000000000007 110.744 -178.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.0 pt-20 -66.8 -25.56 66.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.735 0.302 . . . . 74.120000000000005 110.872 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -99.0 7.26 46.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.337 -0.392 . . . . 65.150000000000006 111.304 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.404 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 77.8 t80 -60.02 -39.34 85.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.708 0.289 . . . . 73.239999999999995 110.466 -179.001 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 . . . . . 0 C--N 1.327 -0.404 0 CA-C-O 121.324 0.583 . . . . 70.140000000000001 110.478 176.597 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.692 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.368 0 N-CA-C 108.805 -0.813 . . . . 74.109999999999999 108.805 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.14 -79.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.799 0.333 . . . . 75.040000000000006 111.502 -176.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.41 -56.32 2.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.1 0.476 . . . . 63.130000000000003 110.112 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -71.28 160.39 32.89 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.757 -0.656 . . . . 61.549999999999997 110.642 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.477 ' HE1' ' CB ' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -76.62 52.26 0.8 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.598 -0.728 . . . . 73.230000000000004 112.251 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.692 ' HD2' ' HB2' ' B' ' 203' ' ' ASN . 55.8 m-85 -55.62 -37.51 68.27 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.965 0.412 . . . . 73.349999999999994 111.179 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -70.49 -20.6 62.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.537 . . . . 74.099999999999994 111.689 -176.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.41 ' NH1' ' HB3' ' A' ' 31' ' ' GLU . 79.4 mtt180 -91.6 -60.6 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.83 0.348 . . . . 73.129999999999995 110.228 -177.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.78 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -56.7 -22.88 38.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.715 -0.675 . . . . 72.120000000000005 112.669 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 212' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -65.97 -24.82 66.87 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.591 0.234 . . . . 71.319999999999993 110.741 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 38.8 mt-10 -83.04 -25.94 31.64 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.423 0.63 . . . . 62.140000000000001 109.865 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.59 -42.84 91.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.351 -0.84 . . . . 70.230000000000004 109.512 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 79.6 mt -68.58 -26.53 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.629 -0.714 . . . . 62.219999999999999 110.221 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.513 ' HB2' ' O ' ' B' ' 213' ' ' GLU . 10.6 mmmm -60.73 -42.27 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.056 -0.52 . . . . 75.239999999999995 111.66 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.576 HD12 HD13 ' A' ' 14' ' ' LEU . 2.6 tm? -64.33 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.164 -0.68 . . . . 63.020000000000003 109.164 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -72.28 -37.55 68.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.777 -0.647 . . . . 74.329999999999998 109.979 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.644 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.2 m-20 -61.0 -34.28 74.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 72.530000000000001 110.689 176.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.07 -38.37 79.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 72.340000000000003 111.572 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -76.61 -22.61 53.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.348 0.594 . . . . 73.219999999999999 110.198 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -78.99 -13.28 59.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.261 -0.882 . . . . 70.5 110.714 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 84.8 mm-40 -72.3 -7.36 49.06 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.336 0.495 . . . . 74.109999999999999 112.336 -176.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.42 ' HB3' HG13 ' B' ' 227' ' ' ILE . 0.6 OUTLIER -71.43 166.8 20.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 72.540000000000006 110.194 -179.675 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.6 t -116.48 3.01 13.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.772 0.32 . . . . 63.32 111.43 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -128.93 7.08 5.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.023 0.379 . . . . 74.099999999999994 112.023 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.42 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.5 mt -109.9 144.45 18.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.284 -0.566 . . . . 75.219999999999999 110.118 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -79.4 142.26 36.13 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.162 -0.927 . . . . 71.049999999999997 109.066 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 39.3 m -60.2 -27.64 67.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.063 0.459 . . . . 75.409999999999997 110.649 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.85 -15.42 76.01 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.912 -0.585 . . . . 74.420000000000002 112.843 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.616 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 68.1 mm-40 -78.25 -18.22 55.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 117.194 0.497 . . . . 74.120000000000005 110.467 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.3 -38.25 10.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.669 -0.696 . . . . 75.040000000000006 110.497 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.1 p -64.4 -38.77 92.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.236 0.541 . . . . 71.400000000000006 110.347 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.12 -37.47 85.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.776 -0.647 . . . . 55.210000000000001 111.103 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.49 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 2.3 p -71.65 -26.41 62.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.97 -0.292 . . . . 54.549999999999997 110.748 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.549 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 6.9 t80 -70.28 -40.63 74.21 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.088 -0.708 . . . . 72.530000000000001 109.088 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.685 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.7 ttm -65.79 -47.87 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.48 -0.782 . . . . 74.439999999999998 111.344 178.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -60.92 -38.42 85.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.995 0.426 . . . . 74.349999999999994 110.701 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.465 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.2 -33.15 75.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 63.420000000000002 111.449 -178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.584 HD13 ' HB3' ' A' ' 36' ' ' PHE . 49.3 tp -70.05 -34.95 73.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.976 0.417 . . . . 70.420000000000002 109.891 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.48 -48.86 77.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.788 -0.642 . . . . 75.329999999999998 110.821 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -77.95 -14.9 59.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 63.310000000000002 111.028 -175.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.598 ' HD2' HG23 ' A' ' 15' ' ' ILE . 28.0 t80 -89.13 -48.91 7.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.222 0.534 . . . . 70.450000000000003 110.349 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -78.58 -16.38 57.48 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.846 -0.615 . . . . 73.150000000000006 112.015 -170.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -66.99 -15.42 63.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.147 0.499 . . . . 61.32 111.008 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -56.96 -31.74 65.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.443 -0.799 . . . . 64.319999999999993 111.506 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.586 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 67.9 m-85 -73.5 -11.64 60.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.316 -0.402 . . . . 73.209999999999994 112.0 -175.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.42 95.76 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.15 -1.024 . . . . 65.519999999999996 111.384 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 249' ' ' SER . . . . . 0.917 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 13.1 m -66.85 -13.17 61.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.057 0.392 . . . . 51.200000000000003 112.057 -175.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.8 t -116.81 18.29 14.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.072 0.463 . . . . 53.539999999999999 110.582 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 30.2 t -83.48 -49.24 9.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 75.239999999999995 111.568 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 1.6 m-85 -139.5 -179.45 5.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.653 0.612 . . . . 74.25 112.653 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.599 ' HG3' HG23 ' B' ' 254' ' ' THR . 15.5 pt-20 -92.13 -36.41 13.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.836 -1.074 . . . . 75.120000000000005 112.043 -171.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.599 HG23 ' HG3' ' B' ' 253' ' ' GLU . 69.8 p -123.17 154.92 38.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.328 -0.396 . . . . 72.109999999999999 110.181 -176.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.404 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 22.7 ptmt -65.04 -29.78 70.71 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.154 0.284 . . . . 71.430000000000007 110.72 -178.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -59.0 -53.03 63.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.281 0.562 . . . . 75.349999999999994 110.849 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.637 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 92.0 mt-30 -78.54 -35.3 46.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.663 -0.699 . . . . 71.430000000000007 110.361 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.917 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 25.6 ttt -64.26 -42.86 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.895 -0.593 . . . . 72.150000000000006 111.105 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.45 -35.48 79.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 75.239999999999995 110.887 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.6 2.9 7.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.925 0.393 . . . . 70.540000000000006 111.459 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.637 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.7 mmmt -114.65 -0.16 13.71 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 109.895 -0.409 . . . . 73.140000000000001 109.895 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.458 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 9.9 ptmt -55.22 -52.17 64.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.84 -0.618 . . . . 61.149999999999999 110.942 -173.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.458 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 5.7 tp-100 -76.72 -26.05 54.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 109.985 -0.376 . . . . 71.239999999999995 109.985 -177.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -75.05 -34.13 61.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.05 -0.523 . . . . 75.340000000000003 111.633 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 22.0 ptp -81.49 -29.26 33.73 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.372 -0.973 . . . . 75.409999999999997 108.372 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.478 ' HG2' HD22 ' A' ' 77' ' ' LEU . 68.0 mtp -80.86 -19.17 45.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.914 -1.039 . . . . 71.409999999999997 111.253 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -68.64 -27.32 65.9 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-O 122.079 0.942 . . . . 73.549999999999997 108.5 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -99.94 8.8 43.81 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.216 -1.356 . . . . 71.219999999999999 111.277 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.4 m-30 -97.05 -45.93 6.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 106.951 -1.5 . . . . 74.310000000000002 106.951 165.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.591 ' HE1' HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -59.69 -66.05 0.58 Allowed 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.407 -0.815 . . . . 73.519999999999996 110.53 170.486 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 271' ' ' ASP . . . . . 0.575 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 4.8 t70 -102.03 76.5 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.101 0.408 . . . . 73.209999999999994 112.101 -171.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.575 ' HG2' ' O ' ' B' ' 271' ' ' ASP . 1.8 mmp_? -152.23 -28.92 0.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 72.120000000000005 111.383 170.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.568 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.62 1.44 42.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.525 -0.917 . . . . 74.230000000000004 108.525 174.613 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.48 -49.32 77.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.485 -1.234 . . . . 64.120000000000005 110.692 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.75 -42.65 99.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 73.120000000000005 110.866 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 54.3 mtt -61.55 -47.65 84.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.625 -0.716 . . . . 73.0 109.676 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.677 HD21 ' HD2' ' A' ' 69' ' ' TYR . 34.3 tp -59.9 -42.86 94.77 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.644 -1.162 . . . . 52.439999999999998 111.165 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.94 -43.13 99.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.196 0.522 . . . . 73.209999999999994 110.14 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.04 -20.75 60.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.391 -0.822 . . . . 53.039999999999999 111.525 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -87.95 -9.51 53.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 74.299999999999997 110.634 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.428 ' HG2' ' HB1' ' A' ' 45' ' ' ALA . 58.3 mtt -93.35 -169.23 2.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.104 -0.498 . . . . 75.319999999999993 111.07 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.782 ' HG2' HD12 ' B' ' 285' ' ' ILE . 38.4 mt-10 69.47 13.93 8.36 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.899 -1.046 . . . . 75.319999999999993 112.311 177.075 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -65.48 -47.03 77.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.958 0.409 . . . . 71.5 110.073 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 284' ' ' TYR . . . . . 0.459 ' O ' ' HB2' ' B' ' 288' ' ' PHE . 4.3 m-85 -89.45 -5.44 57.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.508 -0.315 . . . . 72.430000000000007 111.006 174.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.782 HD12 ' HG2' ' B' ' 282' ' ' GLU . 60.8 mt -79.54 -59.79 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 110.138 -0.319 . . . . 60.399999999999999 110.138 178.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 3.1 pt-20 -65.56 -27.89 68.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.867 0.365 . . . . 45.109999999999999 110.701 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -98.52 7.09 46.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.426 -0.352 . . . . 75.040000000000006 111.054 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' B' ' 284' ' ' TYR . 76.9 t80 -64.35 -37.54 87.87 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.93 -0.767 . . . . 71.129999999999995 108.93 174.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 115.414 -0.812 . . . . 72.329999999999998 110.252 173.109 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.63 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.9 p-10 . . . . . 0 N--CA 1.452 -0.361 0 CA-C-O 121.096 0.474 . . . . 71.030000000000001 110.769 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.79 -72.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.583 -0.735 . . . . 72.400000000000006 111.111 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -120.63 -57.59 1.89 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.196 -0.456 . . . . 74.219999999999999 109.822 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.29 161.94 28.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.871 -0.604 . . . . 75.140000000000001 110.981 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.53 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -79.72 54.85 1.9 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.384 -0.826 . . . . 62.340000000000003 111.948 -179.078 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 33.0 m-85 -52.14 -45.29 64.94 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.379 -0.373 . . . . 73.140000000000001 111.962 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.54 -10.57 58.67 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 112.441 0.534 . . . . 64.239999999999995 112.441 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.463 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 95.5 mtt180 -91.33 -62.07 1.52 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.901 -0.407 . . . . 54.310000000000002 109.901 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.773 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.28 -25.03 31.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.772 0.656 . . . . 71.319999999999993 112.772 -178.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 15.1 t -64.73 -20.81 66.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.147 -0.221 . . . . 75.030000000000001 111.321 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HB2' HD11 ' B' ' 217' ' ' LEU . 39.7 mt-10 -86.22 -30.81 22.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.423 -0.584 . . . . 73.5 109.423 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.68 -47.08 82.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.168 -0.924 . . . . 75.329999999999998 109.021 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.46 HG13 ' HB1' ' B' ' 239' ' ' ALA . 72.3 mt -67.16 -29.87 47.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.483 -0.781 . . . . 73.400000000000006 110.389 175.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 12' ' ' THR . 1.2 tmmt? -64.02 -32.31 73.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 62.149999999999999 110.475 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 17' ' ' LEU . 1.6 tm? -69.33 -43.88 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.997 -0.742 . . . . 75.530000000000001 108.997 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.8 84.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.947 -0.569 . . . . 71.540000000000006 110.694 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.529 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 8.0 m-80 -59.4 -32.89 70.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.842 -0.617 . . . . 73.409999999999997 110.944 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -73.88 -31.82 63.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 60.109999999999999 111.53 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -84.73 -22.33 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.827 0.346 . . . . 72.209999999999994 111.023 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -83.6 -0.48 50.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.275 0.56 . . . . 62.450000000000003 110.088 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.2 mm-40 -75.69 -13.69 60.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 73.230000000000004 109.814 173.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -69.2 114.98 7.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.513 -0.767 . . . . 72.010000000000005 109.681 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -62.65 -34.54 77.29 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.405 0.891 . . . . 70.030000000000001 113.405 -170.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 pm0 -90.96 1.19 57.24 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.42 -0.512 . . . . 73.430000000000007 112.175 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.443 ' CG2' ' HB2' ' A' ' 31' ' ' GLU . 7.6 mt -104.09 149.46 7.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.423 0.63 . . . . 75.140000000000001 110.158 177.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.545 ' CG ' ' HG3' ' A' ' 31' ' ' GLU . 16.8 pt20 -90.46 155.74 18.7 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.104 -0.953 . . . . 74.319999999999993 109.143 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 m -60.73 -21.51 63.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.478 0.656 . . . . 65.439999999999998 110.259 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.45 ' HA2' ' CZ ' ' B' ' 247' ' ' PHE . . . -67.15 -39.85 92.63 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.38 -0.827 . . . . 73.329999999999998 113.283 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.545 ' HG3' ' CG ' ' A' ' 28' ' ' GLN . 42.8 mt-10 -67.85 -32.03 72.27 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 117.488 0.644 . . . . 75.239999999999995 110.317 -174.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -72.68 -41.37 62.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.565 -0.743 . . . . 74.329999999999998 110.385 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -61.83 -44.73 96.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.211 0.529 . . . . 72.409999999999997 110.277 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.24 -32.55 73.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.867 -0.606 . . . . 62.020000000000003 111.031 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 48.8 m -66.0 -37.95 87.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 121.046 0.45 . . . . 61.329999999999998 109.905 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.649 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.6 t80 -63.77 -40.01 95.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.731 -0.668 . . . . 53.530000000000001 109.774 177.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.76 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.9 ttm -66.47 -46.19 77.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.609 -0.723 . . . . 65.540000000000006 111.831 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.453 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 19.9 t-105 -63.08 -36.94 85.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 74.129999999999995 110.947 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.497 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -66.44 -37.89 86.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.094 -0.503 . . . . 74.519999999999996 111.493 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.588 HD13 ' HB3' ' B' ' 236' ' ' PHE . 44.4 tp -69.98 -28.45 65.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.013 0.435 . . . . 72.400000000000006 110.375 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.561 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -63.16 -42.26 99.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.948 -0.569 . . . . 73.340000000000003 111.0 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -77.41 -28.91 52.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.923 0.392 . . . . 72.329999999999998 110.574 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -76.7 -35.13 58.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.124 -0.489 . . . . 74.430000000000007 110.574 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -77.92 -32.17 51.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.308 -0.405 . . . . 73.109999999999999 112.048 -178.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.89 -20.65 66.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.266 0.555 . . . . 51.439999999999998 110.708 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -60.13 -33.56 72.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.265 -0.879 . . . . 72.530000000000001 111.078 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.9 m-85 -77.92 -3.49 42.07 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.154 -0.475 . . . . 75.239999999999995 112.156 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.51 -27.48 70.94 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.163 -1.018 . . . . 72.209999999999994 110.748 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.774 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 3.7 m -65.32 -18.1 65.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.13 -0.535 . . . . 72.349999999999994 111.833 -177.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -114.69 20.33 15.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.056 0.455 . . . . 71.400000000000006 110.88 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -83.48 -59.51 2.42 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.375 -0.375 . . . . 72.019999999999996 111.586 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.698 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 4.8 m-85 -134.86 175.32 9.67 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.106 0.41 . . . . 64.219999999999999 112.106 -175.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.527 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.0 pt-20 -82.37 -40.29 21.53 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.707 -0.678 . . . . 75.450000000000003 111.854 -170.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.527 HG23 ' HG3' ' A' ' 53' ' ' GLU . 80.6 p -119.65 155.48 32.25 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.865 -0.42 . . . . 43.109999999999999 109.865 -178.343 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.5 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 12.1 ptmm? -67.44 -26.41 66.39 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.581 -0.448 . . . . 72.120000000000005 110.418 -176.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.0 -26.83 65.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.188 -0.46 . . . . 55.109999999999999 111.038 -177.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.734 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 88.2 mt-30 -97.21 -43.54 7.31 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.521 -0.548 . . . . 73.340000000000003 109.521 175.223 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.774 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 11.2 ttt -55.31 -44.21 75.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.169 -0.923 . . . . 55.030000000000001 111.721 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.427 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 47.5 tt0 -63.9 -42.42 97.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.077 -0.511 . . . . 65.510000000000005 110.827 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.71 -2.85 18.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.028 -0.533 . . . . 75.519999999999996 111.712 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.734 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 73.4 mmtt -104.1 1.05 30.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.422 -0.354 . . . . 52.140000000000001 110.826 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.528 ' O ' ' HG3' ' A' ' 66' ' ' MET . 0.0 OUTLIER -52.93 -46.01 67.92 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 123.209 0.318 . . . . 74.400000000000006 110.809 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.471 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 4.1 tp-100 -77.91 -27.96 49.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.045 0.45 . . . . 74.019999999999996 110.014 -174.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -74.17 -29.38 61.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.892 -0.594 . . . . 72.319999999999993 111.176 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 ptp -86.1 -28.08 24.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.488 -0.56 . . . . 74.439999999999998 109.488 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.637 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 86.2 mtp -75.34 -18.14 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.548 -0.751 . . . . 73.140000000000001 111.313 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.0 -31.85 73.08 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.861 0.839 . . . . 51.409999999999997 109.465 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.44 ' HD2' ' CD ' ' A' ' 72' ' ' ARG . 85.9 m-85 -93.73 -4.34 50.6 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.639 -1.164 . . . . 73.349999999999994 111.155 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.637 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.8 m-30 -86.49 -53.87 4.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.014 -1.106 . . . . 74.420000000000002 108.014 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.548 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -58.96 -65.43 0.67 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.999 -0.546 . . . . 64.230000000000004 111.602 175.553 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.568 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 0.1 OUTLIER -98.77 24.2 7.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.861 1.43 . . . . 74.230000000000004 114.861 -159.807 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.44 ' CD ' ' HD2' ' A' ' 68' ' ' TYR . 1.2 mmp_? -112.96 -19.92 11.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.388 -0.925 . . . . 51.520000000000003 112.997 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.664 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -88.78 5.01 45.53 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.745 -0.835 . . . . 73.129999999999995 108.745 173.251 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -61.57 -57.75 10.83 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.414 -1.266 . . . . 74.030000000000001 110.519 -177.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.34 -33.68 76.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.183 -0.462 . . . . 70.209999999999994 111.708 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.496 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 44.6 mtm -74.35 -23.29 59.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.276 0.56 . . . . 50.450000000000003 110.16 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.557 HD22 ' HG2' ' B' ' 266' ' ' MET . 3.4 tt -76.68 -35.29 58.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.566 -0.743 . . . . 71.219999999999999 109.209 176.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.457 ' N ' ' HE1' ' B' ' 266' ' ' MET . 25.2 t70 -59.6 -37.21 77.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.054 -0.976 . . . . 55.109999999999999 111.213 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.37 -19.5 63.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.8 -0.636 . . . . 64.310000000000002 112.095 -178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.24 -3.51 31.32 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 74.319999999999993 111.852 -176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.489 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 24.1 mmt -85.51 -176.26 6.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.696 0.284 . . . . 74.430000000000007 110.534 175.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.756 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 63.0 -10.46 0.1 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 114.027 1.121 . . . . 74.019999999999996 114.027 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -56.17 -65.37 0.61 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.039 0.447 . . . . 63.520000000000003 111.381 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -72.91 -13.38 61.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.29 -0.414 . . . . 72.230000000000004 110.905 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.756 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.6 mt -76.89 -54.32 13.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.431 . . . . 72.430000000000007 110.83 -176.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.2 pt-20 -68.7 -22.37 64.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.982 0.42 . . . . 73.219999999999999 111.106 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -98.57 3.34 48.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.291 -0.413 . . . . 74.219999999999999 110.878 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 73.3 t80 -64.73 -37.42 87.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.733 -0.212 . . . . 75.409999999999997 110.491 -177.001 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 121.584 0.707 . . . . 74.219999999999999 109.76 174.423 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.72 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 2.8 p-10 . . . . . 0 N--CA 1.449 -0.475 0 CA-C-O 121.023 0.439 . . . . 64.140000000000001 109.913 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -77.02 -76.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.995 -0.548 . . . . 55.420000000000002 110.891 -177.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -106.75 -45.31 4.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.472 0.653 . . . . 72.219999999999999 109.863 -178.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.72 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -102.18 169.33 8.79 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 73.140000000000001 111.173 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.53 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -83.77 54.25 2.82 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.833 0.853 . . . . 75.140000000000001 112.063 -177.474 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' B' ' 206' ' ' ALA . 29.1 m-85 -53.81 -43.54 69.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.474 . . . . 71.129999999999995 112.086 -175.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -71.34 -5.83 35.44 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.628 0.603 . . . . 43.240000000000002 112.628 -175.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -98.97 -59.97 1.62 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.906 -0.405 . . . . 73.239999999999995 109.906 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.909 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -59.35 -18.52 39.15 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.845 0.683 . . . . 63.119999999999997 112.845 -178.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.8 t -66.95 -19.62 65.75 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.131 -0.228 . . . . 61.439999999999998 111.094 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.407 ' HB2' HD11 ' A' ' 17' ' ' LEU . 33.4 mt-10 -86.67 -26.62 24.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.189 0.519 . . . . 73.230000000000004 109.894 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.909 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.45 -47.87 74.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.406 -0.815 . . . . 72.340000000000003 109.547 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.483 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.5 mt -66.3 -30.17 49.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.801 -0.636 . . . . 65.430000000000007 110.127 175.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' B' ' 216' ' ' LYS . 1.1 tmmt? -64.06 -31.85 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.575 -0.739 . . . . 71.120000000000005 111.204 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.668 HD12 HD13 ' A' ' 14' ' ' LEU . 2.8 tm? -67.86 -42.0 81.99 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.664 -0.865 . . . . 71.319999999999993 108.664 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.19 -35.8 76.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.677 -0.692 . . . . 60.130000000000003 110.719 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.434 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 5.6 m-20 -63.2 -25.54 68.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.052 -0.522 . . . . 72.209999999999994 111.347 179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.52 -36.26 29.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.45 -0.341 . . . . 71.109999999999999 111.304 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -74.77 -22.82 58.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.276 0.56 . . . . 61.439999999999998 110.354 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -72.65 -17.05 61.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.176 -0.92 . . . . 63.119999999999997 110.084 177.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 78.5 mm-40 -77.32 74.83 3.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.071 -0.513 . . . . 73.540000000000006 110.623 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.483 HD21 ' HA ' ' B' ' 224' ' ' ASN . 0.9 OUTLIER -151.15 176.8 10.83 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.567 -0.901 . . . . 74.109999999999999 108.567 174.434 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.8 t -111.82 -37.94 4.99 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.397 -0.521 . . . . 74.329999999999998 112.082 -176.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -83.32 -28.02 29.35 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.171 0.434 . . . . 71.140000000000001 112.171 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 5.7 mt -76.87 151.01 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 72.519999999999996 110.257 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.603 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 13.8 pm0 -101.96 157.05 17.14 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.872 -0.604 . . . . 73.409999999999997 109.487 173.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 17.8 m -58.18 -23.93 57.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.173 0.511 . . . . 63.140000000000001 110.86 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 230' ' ' GLY . . . . . 0.459 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.84 -35.39 91.85 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.588 -0.733 . . . . 51.420000000000002 113.199 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.603 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 14.9 mm-40 -70.16 -24.84 63.22 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 117.276 0.538 . . . . 64.219999999999999 110.342 -175.245 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.24 -41.47 22.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.737 -0.665 . . . . 74.319999999999993 110.289 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.0 t -62.11 -43.71 98.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 64.239999999999995 110.297 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.7 -33.02 74.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.961 -0.563 . . . . 64.420000000000002 110.983 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.411 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 50.4 m -65.54 -38.41 89.56 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.013 0.435 . . . . 54.509999999999998 110.084 179.245 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.596 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.4 t80 -65.24 -36.53 84.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.587 0.708 . . . . 75.439999999999998 109.501 176.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.664 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.0 ttm -66.41 -49.39 66.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.287 -0.87 . . . . 74.340000000000003 111.949 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.53 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 21.6 t-105 -62.92 -37.82 88.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 71.540000000000006 110.732 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.572 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.89 -36.87 85.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.176 -0.465 . . . . 55.329999999999998 111.304 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 54.5 tp -67.76 -33.65 75.26 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.046 0.45 . . . . 64.120000000000005 110.166 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.547 ' HB1' ' HA ' ' A' ' 77' ' ' LEU . . . -60.99 -48.17 83.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 72.129999999999995 110.988 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -67.87 -34.78 77.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.331 -0.395 . . . . 74.120000000000005 111.08 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -74.14 -38.01 63.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.074 -0.512 . . . . 74.439999999999998 110.726 -176.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -75.2 -28.39 59.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.659 0.244 . . . . 71.140000000000001 111.659 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.489 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.37 -15.6 62.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.286 0.565 . . . . 53.100000000000001 110.809 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -67.05 -33.99 76.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.451 -0.795 . . . . 75.0 110.561 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.45 ' CZ ' ' HA2' ' A' ' 30' ' ' GLY . 76.8 m-85 -78.68 -0.74 31.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.57 . . . . 72.030000000000001 112.044 -176.276 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 248' ' ' GLY . . . . . 0.533 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.93 -36.33 72.85 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.42 -0.895 . . . . 72.140000000000001 111.235 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 249' ' ' SER . . . . . 0.804 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 5.1 m -68.37 -11.83 60.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.469 -0.365 . . . . 53.329999999999998 111.611 -178.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 27.1 p -105.85 1.77 27.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.964 0.411 . . . . 72.010000000000005 110.59 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 32.0 t -77.98 -43.2 30.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.952 -0.567 . . . . 55.229999999999997 111.198 -175.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.503 ' HD1' ' HG2' ' B' ' 253' ' ' GLU . 0.3 OUTLIER -144.0 -179.71 6.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.36 0.6 . . . . 63.5 112.561 -174.08 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.503 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 7.1 pt-20 -94.49 -47.53 6.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.74 -1.118 . . . . 74.340000000000003 111.872 -172.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 74.3 p -111.91 156.49 21.98 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 109.538 -0.541 . . . . 72.239999999999995 109.538 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.3 ptmt -68.02 -31.89 71.88 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.422 -0.511 . . . . 64.340000000000003 110.701 -177.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -65.98 -37.1 85.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.941 0.4 . . . . 52.509999999999998 111.044 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.523 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 98.8 mt-30 -90.55 -14.8 31.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.281 -0.418 . . . . 74.109999999999999 110.828 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.804 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.9 ttt -89.06 -40.17 13.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.942 -0.572 . . . . 74.109999999999999 110.541 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.488 ' O ' ' HD2' ' B' ' 262' ' ' LYS . 32.8 tt0 -63.02 -34.52 77.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 73.450000000000003 110.802 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.68 -3.63 19.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.352 -0.386 . . . . 71.340000000000003 110.709 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 73.3 mmtt -115.62 -9.65 11.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.323 -0.398 . . . . 61.32 112.055 -176.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.664 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 0.0 OUTLIER -64.5 -27.07 68.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 120.021 -0.671 . . . . 71.540000000000006 110.73 -173.133 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -83.36 -41.12 18.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 110.108 -0.33 . . . . 75.319999999999993 110.108 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -62.59 -42.42 99.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 75.5 111.836 -177.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.664 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 24.3 ptp -68.25 -29.84 68.75 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.085 -0.709 . . . . 71.420000000000002 109.085 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.557 ' HG2' HD22 ' A' ' 77' ' ' LEU . 52.5 mtp -75.86 -36.31 59.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.161 -0.927 . . . . 72.329999999999998 110.92 178.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.53 -31.76 72.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 75.519999999999996 111.001 -165.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.683 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 17.6 p90 -97.02 -11.98 23.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.222 -0.445 . . . . 71.340000000000003 110.984 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.415 ' HD1' ' HA ' ' B' ' 269' ' ' TYR . 2.5 m-30 -60.48 -47.66 85.18 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 110.135 -0.32 . . . . 51.329999999999998 110.135 177.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.568 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -49.68 -45.73 49.08 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.672 -0.694 . . . . 70.340000000000003 110.231 174.135 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -92.1 26.06 2.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.86 -1.064 . . . . 65.519999999999996 111.698 -169.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.683 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 3.6 mmp_? -97.87 -46.79 5.81 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.729 -0.607 . . . . 65.109999999999999 111.455 -177.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.76 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -89.64 10.78 21.88 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.329 -0.548 . . . . 74.430000000000007 110.547 -178.575 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.441 ' HE3' ' HG2' ' A' ' 70' ' ' MET . 29.4 ttmt -60.32 -53.94 51.59 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.702 -0.681 . . . . 74.209999999999994 110.454 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.52 -40.88 96.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 71.319999999999993 111.492 -176.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 60.5 mtm -73.74 -29.78 62.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 52.140000000000001 110.663 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 4.8 tt -72.6 -43.68 63.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 75.109999999999999 109.507 177.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.54 -27.86 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.815 -0.63 . . . . 72.430000000000007 110.821 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.4 57.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 52.200000000000003 111.548 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -95.39 -8.36 35.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.227 0.536 . . . . 74.099999999999994 110.274 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 20.6 mmt -73.74 178.06 5.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.619 -0.719 . . . . 75.310000000000002 111.226 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.748 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 40.4 mt-10 70.09 -5.22 1.34 Allowed 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 113.998 1.111 . . . . 63.350000000000001 113.998 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.28 -68.5 0.34 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.116 0.417 . . . . 73.420000000000002 110.586 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -60.4 -28.72 68.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.848 0.356 . . . . 71.349999999999994 110.832 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.748 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 61.9 mt -64.53 -55.04 23.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.564 . . . . 71.120000000000005 111.628 -176.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.7 pt-20 -63.12 -25.95 68.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.907 0.384 . . . . 75.030000000000001 111.29 -177.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -97.27 5.62 49.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.191 -0.459 . . . . 65.430000000000007 111.196 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -54.99 -52.85 61.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.648 0.24 . . . . 64.25 111.648 -176.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 . . . . . 0 C--N 1.327 -0.383 0 CA-C-O 120.638 0.256 . . . . 65.5 111.249 -177.104 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.449 -0.486 0 CA-C-O 120.921 0.391 . . . . 72.140000000000001 110.075 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.94 99.88 9.34 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 54.149999999999999 110.607 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 48.3 t30 72.59 -60.77 0.52 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.333 -0.848 . . . . 72.200000000000003 111.537 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.1 154.55 29.28 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.892 -0.595 . . . . 34.049999999999997 111.65 -176.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.513 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -79.13 51.24 1.14 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.961 -1.018 . . . . 63.530000000000001 112.608 -175.787 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -54.03 -41.22 67.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.854 0.359 . . . . 72.040000000000006 111.154 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -4.77 34.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 35.43 112.361 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.46 ' NH2' ' HB3' ' B' ' 221' ' ' GLN . 60.7 mtp85 -99.86 -61.1 1.41 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.214 -0.291 . . . . 72.140000000000001 110.214 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.874 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.43 -22.49 12.73 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.77 0.656 . . . . 73.219999999999999 112.77 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.4 t -63.18 -22.71 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.706 0.289 . . . . 71.109999999999999 111.153 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.51 ' HB2' HD11 ' B' ' 217' ' ' LEU . 74.6 mt-10 -90.39 -28.08 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.075 0.464 . . . . 74.439999999999998 110.004 -178.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.874 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.8 mm? -62.39 -42.62 99.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 65.409999999999997 110.097 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.01 -23.21 21.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.506 -0.77 . . . . 73.030000000000001 111.093 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -64.22 -28.98 70.11 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 111.065 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 213' ' ' GLU . 2.1 tm? -74.52 -43.23 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.438 -0.579 . . . . 63.219999999999999 109.438 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.28 75.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.965 -0.562 . . . . 62.439999999999998 111.416 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -66.45 -18.38 65.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.431 -0.349 . . . . 65.019999999999996 111.768 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -77.24 -23.63 51.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.431 0.634 . . . . 72.420000000000002 109.864 177.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -99.23 -11.91 20.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.733 -0.667 . . . . 73.040000000000006 110.07 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.859 ' HA ' HG21 ' A' ' 32' ' ' VAL . 15.3 t-20 -86.57 -21.44 26.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.495 -0.775 . . . . 63.340000000000003 110.064 -177.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -80.67 18.94 0.87 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.185 -0.462 . . . . 74.329999999999998 111.998 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.74 107.2 15.19 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.121 -1.066 . . . . 63.43 108.121 174.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -59.64 -32.38 70.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.807 0.669 . . . . 63.009999999999998 112.807 -171.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -91.44 11.77 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.768 0.655 . . . . 73.340000000000003 112.768 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.2 mt -120.52 152.07 23.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.022 0.439 . . . . 65.219999999999999 110.7 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.677 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 47.0 mt-30 -73.65 152.9 40.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 73.340000000000003 110.143 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.443 HG23 HD22 ' A' ' 22' ' ' ASN . 13.5 m -65.25 -34.15 77.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.206 0.527 . . . . 74.430000000000007 110.841 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.1 -2.43 78.19 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.954 -0.566 . . . . 74.150000000000006 113.708 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.677 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 52.5 mm-40 -86.47 -12.03 50.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.502 0.651 . . . . 54.340000000000003 110.246 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.859 HG21 ' HA ' ' A' ' 22' ' ' ASN . 21.3 t -91.74 -36.88 8.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.793 -0.64 . . . . 73.239999999999995 111.181 -176.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.9 p -58.65 -31.39 68.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 62.030000000000001 110.955 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.11 79.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.796 -0.638 . . . . 62.43 111.274 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.8 m -66.65 -36.38 82.42 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.123 0.487 . . . . 63.310000000000002 110.051 -178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CD1' HD12 ' B' ' 214' ' ' LEU . 8.6 t80 -67.86 -35.54 78.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.761 -0.654 . . . . 62.119999999999997 109.509 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.597 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 11.5 ttt -66.48 -55.83 13.75 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.368 -0.833 . . . . 73.450000000000003 111.644 -178.304 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.62 ' CZ3' ' HB3' ' B' ' 276' ' ' MET . 16.7 t-105 -55.2 -41.1 71.53 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.283 -0.417 . . . . 73.299999999999997 111.142 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.454 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -60.72 -36.64 79.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.244 -0.434 . . . . 61.130000000000003 111.059 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.718 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.9 tp -69.69 -35.97 75.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 72.349999999999994 110.271 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.68 -49.92 75.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.774 -0.648 . . . . 32.109999999999999 111.306 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -80.21 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.51 -0.476 . . . . 70.310000000000002 111.297 -176.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -86.25 -39.49 16.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.402 -0.592 . . . . 75.299999999999997 109.402 175.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -72.81 -30.5 64.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 75.219999999999999 111.116 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.608 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -72.37 -17.06 61.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 72.219999999999999 111.104 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -56.14 -38.19 70.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.846 -0.616 . . . . 72.450000000000003 110.373 177.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.553 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 69.7 m-85 -76.17 -11.31 59.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.734 -0.666 . . . . 72.219999999999999 112.072 -177.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.43 -33.55 85.07 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.394 -0.908 . . . . 63.039999999999999 111.484 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.712 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 60.2 p -60.76 -37.86 83.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.98 0.419 . . . . 71.209999999999994 111.493 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.6 t -95.07 13.98 23.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.149 0.5 . . . . 51.350000000000001 110.842 -175.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.1 t -76.36 -39.26 54.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 75.010000000000005 111.728 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.664 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -140.07 -167.67 2.36 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.481 -0.487 . . . . 73.019999999999996 112.258 -176.418 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.65 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.0 pt-20 -104.59 -40.33 6.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.373 -0.831 . . . . 54.409999999999997 111.686 -174.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.5 p -118.02 162.64 17.83 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.877 -0.416 . . . . 70.219999999999999 109.877 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.61 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 18.4 ptmt -71.66 -35.33 70.32 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.642 -0.423 . . . . 72.040000000000006 110.797 -177.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -64.93 -42.84 94.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.31 -0.405 . . . . 72.219999999999999 111.118 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.548 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 88.2 mt-30 -77.18 -36.1 55.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.886 0.374 . . . . 73.340000000000003 110.36 178.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.712 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 15.9 ttt -63.25 -40.28 96.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.046 -0.525 . . . . 71.129999999999995 110.687 177.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.522 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.2 tt0 -62.11 -33.74 75.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.713 -0.676 . . . . 63.119999999999997 111.053 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.51 -1.61 38.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.353 -0.385 . . . . 53.240000000000002 111.421 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.664 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.9 mmmt -108.77 -0.38 19.98 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.408 -0.36 . . . . 71.430000000000007 111.413 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.624 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.0 ptpt -57.51 -50.81 71.86 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 123.3 0.375 . . . . 72.329999999999998 110.535 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.624 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -75.43 -14.17 60.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.428 -0.351 . . . . 75.519999999999996 110.623 -176.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -82.73 -44.86 15.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 73.5 111.431 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 3.9 ptt? -79.75 -22.49 43.17 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 119.914 -0.714 . . . . 73.140000000000001 109.617 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.475 ' HG2' HD22 ' B' ' 277' ' ' LEU . 56.9 mtp -89.44 -7.9 54.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.589 -0.732 . . . . 71.329999999999998 110.587 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -57.68 -45.47 85.56 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.166 0.508 . . . . 72.239999999999995 110.808 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.657 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 7.1 p90 -110.52 6.06 21.71 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.377 -0.829 . . . . 74.310000000000002 110.333 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.559 ' O ' ' HE1' ' B' ' 237' ' ' MET . 0.8 OUTLIER -63.16 -53.67 49.7 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.217 -0.66 . . . . 71.549999999999997 109.217 173.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.473 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -55.88 -45.2 78.63 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.092 -0.706 . . . . 74.329999999999998 109.092 174.228 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.412 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 7.5 t70 -96.84 57.08 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.852 -1.067 . . . . 61.310000000000002 110.93 -173.519 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 7.8 mmm180 -122.29 -46.57 2.17 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 120.999 0.428 . . . . 73.310000000000002 110.648 172.105 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.774 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -92.25 12.56 21.98 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.49 0.662 . . . . 70.019999999999996 109.455 -178.529 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.564 ' HG3' ' SD ' ' B' ' 270' ' ' MET . 65.0 tttt -60.63 -63.82 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.463 -1.244 . . . . 72.140000000000001 110.658 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.27 -37.4 83.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.057 -0.52 . . . . 62.119999999999997 111.289 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.478 ' HB3' ' CZ3' ' B' ' 238' ' ' TRP . 47.3 mtm -69.05 -31.5 70.32 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 74.209999999999994 110.407 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.538 HD22 ' HG2' ' B' ' 266' ' ' MET . 5.6 tt -73.56 -42.14 62.04 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.549 -0.537 . . . . 61.350000000000001 109.549 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.619 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 23.1 t70 -61.53 -35.27 77.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.818 -0.628 . . . . 64.109999999999999 110.329 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.32 -13.72 62.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.444 -0.798 . . . . 53.350000000000001 111.523 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -100.61 -21.38 15.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.071 0.462 . . . . 64.510000000000005 109.759 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.521 ' O ' HG13 ' A' ' 85' ' ' ILE . 20.8 mmt -68.21 -55.73 11.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.832 -0.622 . . . . 71.219999999999999 110.18 174.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 12.5 pt-20 -57.29 -26.06 60.25 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 115.556 -0.747 . . . . 75.099999999999994 111.278 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -53.04 -48.49 67.6 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.042 0.448 . . . . 73.530000000000001 110.409 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -84.15 -25.01 29.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.152 -0.476 . . . . 71.5 110.721 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 81' ' ' MET . 67.5 mt -69.47 -56.87 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 74.25 110.919 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.632 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.1 pt-20 -68.96 -19.74 64.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 53.039999999999999 111.163 -176.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -103.95 18.88 21.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.516 -0.311 . . . . 74.129999999999995 111.174 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 21.4 t80 -56.84 -54.67 43.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.98 -0.378 . . . . 72.420000000000002 109.98 177.247 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.372 -0.376 . . . . 74.299999999999997 111.399 -179.357 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 109.997 -0.372 . . . . 63.009999999999998 109.997 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 204' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 36.2 tt0 -78.93 81.55 5.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.129 -0.487 . . . . 71.409999999999997 110.854 -178.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 72.64 -60.94 0.52 Allowed 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 124.107 0.963 . . . . 72.519999999999996 110.658 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -73.12 160.54 31.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.809 -0.632 . . . . 73.329999999999998 111.648 -176.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -82.25 49.47 1.42 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.338 -0.846 . . . . 73.140000000000001 111.805 -177.362 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.419 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 67.0 m-85 -53.21 -45.63 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.094 0.473 . . . . 54.409999999999997 110.735 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.97 -18.17 64.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.463 -0.79 . . . . 73.010000000000005 112.212 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.625 HH22 HG22 ' A' ' 32' ' ' VAL . 25.4 mtp180 -90.41 -62.27 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.156 -0.313 . . . . 63.149999999999999 110.156 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.823 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -54.16 -26.75 29.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.091 0.775 . . . . 63.409999999999997 113.091 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.5 t -65.58 -18.32 65.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.509 0.195 . . . . 75.310000000000002 111.188 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 21.2 mt-10 -96.49 -16.73 20.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.062 0.458 . . . . 73.150000000000006 110.391 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.823 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.9 mm? -69.11 -45.01 71.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.888 -0.782 . . . . 72.299999999999997 108.888 173.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.444 HG13 ' HB1' ' A' ' 39' ' ' ALA . 66.7 mt -69.2 -24.85 28.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.394 -0.821 . . . . 74.109999999999999 110.339 175.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.7 tmtp? -59.69 -35.71 75.03 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.678 -0.692 . . . . 72.329999999999998 110.709 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.75 HD12 HD13 ' A' ' 14' ' ' LEU . 3.0 tm? -71.41 -42.35 68.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.185 -0.672 . . . . 74.530000000000001 109.185 176.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.59 -39.07 86.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 75.230000000000004 111.04 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -61.22 -33.77 74.03 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.849 0.357 . . . . 74.310000000000002 111.074 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -34.78 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 74.209999999999994 110.459 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 221' ' ' GLN . . . . . 0.46 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 56.3 mt-30 -82.77 -17.34 44.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.364 0.602 . . . . 73.329999999999998 110.255 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 222' ' ' ASN . . . . . 0.518 ' HA ' HG21 ' B' ' 232' ' ' VAL . 8.8 t30 -76.25 -5.47 47.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.154 -0.93 . . . . 75.329999999999998 109.779 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -77.41 2.37 16.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 73.209999999999994 111.356 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.43 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -58.7 131.99 52.54 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.099 0.476 . . . . 71.299999999999997 110.262 175.721 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.8 t -94.69 -22.96 17.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.834 -0.621 . . . . 73.420000000000002 110.063 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 226' ' ' GLU . . . . . 0.468 ' HG2' HG13 ' B' ' 227' ' ' ILE . 1.5 pm0 -88.73 -21.82 23.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.65 -0.704 . . . . 71.530000000000001 111.455 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.468 HG13 ' HG2' ' B' ' 226' ' ' GLU . 6.3 mt -110.01 150.95 12.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.873 0.368 . . . . 75.420000000000002 110.619 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -93.44 175.56 6.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.836 -0.62 . . . . 54.509999999999998 110.193 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 3.4 m -64.29 -31.56 72.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.156 -0.474 . . . . 71.530000000000001 111.588 -175.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 230' ' ' GLY . . . . . 0.553 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -61.5 -25.62 65.41 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 114.865 0.706 . . . . 71.5 114.865 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -88.06 -15.99 34.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.697 0.748 . . . . 63.420000000000002 111.635 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 232' ' ' VAL . . . . . 0.518 HG21 ' HA ' ' B' ' 222' ' ' ASN . 35.9 t -81.11 -37.4 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.963 -0.295 . . . . 64.099999999999994 110.896 -176.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 8.7 p -60.25 -34.64 73.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.286 0.565 . . . . 53.109999999999999 110.567 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.11 -32.02 72.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.751 . . . . 60.32 111.635 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 18.3 m -67.64 -32.81 73.76 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.137 0.494 . . . . 71.409999999999997 109.738 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.655 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 4.7 t80 -71.91 -34.81 69.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 74.329999999999998 109.239 177.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.774 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.9 tpt -60.41 -55.81 29.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 74.010000000000005 110.916 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.513 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 28.3 t-105 -63.87 -33.8 76.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.73 -0.668 . . . . 75.549999999999997 111.739 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.459 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.99 -39.61 93.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.597 -0.274 . . . . 63.299999999999997 111.16 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.462 HD21 ' HG3' ' A' ' 37' ' ' MET . 61.6 tp -68.19 -29.94 68.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.931 0.396 . . . . 74.340000000000003 110.416 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.09 -47.47 82.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.933 -0.576 . . . . 64.140000000000001 111.303 -178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -84.01 -5.97 59.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.846 -0.342 . . . . 65.150000000000006 110.902 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -89.37 -41.03 12.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.231 -0.655 . . . . 74.109999999999999 109.231 175.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -75.18 -36.73 61.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.791 -0.64 . . . . 72.239999999999995 111.761 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.409 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -68.01 -17.14 64.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.061 0.457 . . . . 71.340000000000003 111.021 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -68.05 -17.82 64.51 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 72.349999999999994 110.009 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -96.71 -0.06 48.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.124 -0.489 . . . . 75.040000000000006 111.206 177.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 248' ' ' GLY . . . . . 0.402 ' HA3' ' SD ' ' A' ' 81' ' ' MET . . . -75.8 -29.77 58.78 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.6 -0.81 . . . . 34.450000000000003 111.671 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 18.6 p -72.11 -18.12 61.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.865 0.365 . . . . 61.240000000000002 111.235 -177.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 15.3 t -103.95 16.79 25.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.538 0.685 . . . . 64.239999999999995 110.117 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 10.6 t -82.06 -44.21 16.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.585 -0.734 . . . . 72.200000000000003 110.329 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.724 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 0.4 OUTLIER -138.94 -172.37 3.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.471 -0.331 . . . . 61.539999999999999 111.159 -179.602 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -102.96 -44.57 5.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.109999999999999 111.592 -173.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 56.4 p -107.33 151.63 25.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.72 -0.218 . . . . 64.019999999999996 110.551 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.471 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 22.5 ptmt -63.27 -32.51 73.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.4 . . . . 65.530000000000001 110.636 -178.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -60.14 -54.17 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.859 -0.609 . . . . 62.520000000000003 110.299 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.665 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 96.4 mt-30 -71.4 -42.88 67.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.838 -0.619 . . . . 72.019999999999996 110.363 -178.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 14.5 ttt -57.27 -42.06 80.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 50.210000000000001 111.233 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -63.23 -33.02 74.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.061 -0.518 . . . . 72.519999999999996 111.245 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -78.3 -4.51 48.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.992 0.425 . . . . 44.43 111.061 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.724 ' HE2' ' HE2' ' B' ' 252' ' ' PHE . 27.1 mmmt -112.91 3.83 16.51 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.156 -176.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.651 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 17.3 ptpt -55.86 -52.97 62.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.073 -0.512 . . . . 54.130000000000003 110.647 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.651 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 5.5 tp-100 -66.57 -30.55 70.88 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.529 -0.305 . . . . 70.400000000000006 110.789 -176.302 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.437 -0.347 . . . . 75.120000000000005 111.53 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.533 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 4.8 ptt? -79.47 -28.13 41.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 120.274 -0.57 . . . . 54.240000000000002 110.191 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.619 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 72.8 mtp -77.32 -24.24 50.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.718 -0.674 . . . . 44.140000000000001 111.613 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -66.19 -25.95 67.17 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.53 0.681 . . . . 50.130000000000003 109.214 -174.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 28.1 m-85 -94.29 -17.24 22.83 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.893 -1.048 . . . . 55.149999999999999 111.35 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.485 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.5 m-30 -72.55 -40.45 66.7 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.247 -1.02 . . . . 63.539999999999999 108.247 171.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.564 ' SD ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.75 -63.61 1.09 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.033 -0.531 . . . . 74.209999999999994 110.386 169.701 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -98.84 76.87 2.19 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.742 0.645 . . . . 74.109999999999999 112.742 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 4.5 mmm180 -152.87 -34.49 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.955 -0.566 . . . . 71.310000000000002 111.081 166.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.597 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.84 0.66 46.62 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 108.988 -0.745 . . . . 74.150000000000006 108.988 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -61.29 -52.58 64.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.806 -1.088 . . . . 74.510000000000005 110.827 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -58.91 -38.74 79.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.192 0.52 . . . . 65.209999999999994 111.129 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 276' ' ' MET . . . . . 0.62 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 55.2 mtm -80.34 -24.69 39.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.836 -0.62 . . . . 63.310000000000002 110.427 -177.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.475 HD22 ' HG2' ' A' ' 66' ' ' MET . 4.9 tt -72.42 -43.45 63.84 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.814 -0.81 . . . . 73.409999999999997 108.814 174.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.93 -39.85 75.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.085 -0.962 . . . . 64.439999999999998 110.291 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -61.91 -24.03 66.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.091 -0.958 . . . . 71.340000000000003 112.008 -177.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -98.4 -13.98 20.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.913 0.387 . . . . 64.030000000000001 110.516 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.608 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 16.1 mmt -69.66 -55.21 10.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.934 -0.575 . . . . 74.409999999999997 110.786 178.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.573 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 7.3 pt-20 -78.61 0.76 25.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.942 -0.572 . . . . 64.549999999999997 112.495 -174.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.73 -45.92 92.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.278 0.561 . . . . 71.209999999999994 109.601 173.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -82.37 -19.72 38.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.543 -0.753 . . . . 72.420000000000002 110.471 177.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.545 ' CG1' ' HA ' ' B' ' 282' ' ' GLU . 68.6 mt -71.87 -55.29 13.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 120.905 0.384 . . . . 74.109999999999999 110.572 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -65.78 -18.53 65.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 64.450000000000003 110.937 -178.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 287' ' ' ASN . . . . . 0.42 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 57.8 m-80 -112.32 18.9 18.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.446 -0.343 . . . . 70.519999999999996 111.462 179.105 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.61 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 26.4 t80 -53.59 -54.6 35.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.699 0.285 . . . . 73.230000000000004 110.833 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.329 -0.396 . . . . 71.239999999999995 111.246 -178.481 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.531 ' N ' HD21 ' A' ' 3' ' ' ASN . 0.7 OUTLIER . . . . . 0 CA--C 1.519 -0.216 0 N-CA-C 110.083 -0.34 . . . . 63.039999999999999 110.083 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.561 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . 3.3 tm-20 -65.28 -43.96 89.54 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.314 -0.995 . . . . 72.430000000000007 108.314 169.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.635 ' H ' ' HE2' ' A' ' 8' ' ' TYR . 9.1 t30 -148.04 -30.33 0.3 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.906 -1.043 . . . . 64.329999999999998 109.767 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.46 -162.75 1.62 Allowed 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 112.511 0.56 . . . . 71.430000000000007 112.511 -173.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.459 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.6 OUTLIER -71.58 42.33 0.08 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.097 1.359 . . . . 51.219999999999999 114.312 -172.396 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.635 ' HE2' ' H ' ' A' ' 5' ' ' ASN . 75.2 m-85 -57.9 -41.5 82.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 118.009 0.368 . . . . 73.340000000000003 111.469 -176.012 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.46 -18.96 65.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 64.400000000000006 111.913 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -92.93 -52.8 4.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.525 0.194 . . . . 74.129999999999995 111.525 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.812 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.6 -25.02 23.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.552 0.575 . . . . 73.409999999999997 112.552 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.9 t -68.13 -23.0 64.84 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.674 0.273 . . . . 65.319999999999993 111.028 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.6 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.3 mt-10 -79.19 -27.22 42.59 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.361 0.6 . . . . 73.109999999999999 109.392 -178.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.812 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -65.75 -48.98 70.04 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.033 -0.985 . . . . 75.109999999999999 109.597 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.502 HG23 ' HD2' ' B' ' 243' ' ' TYR . 81.4 mt -67.82 -29.44 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.587 -0.733 . . . . 63.520000000000003 110.198 176.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.429 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.3 tmmt? -60.18 -30.5 69.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.732 -0.667 . . . . 63.439999999999998 111.023 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.423 HD12 HD13 ' B' ' 214' ' ' LEU . 3.0 tm? -69.32 -45.23 70.01 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.29 -0.633 . . . . 74.430000000000007 109.29 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -32.27 72.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.636 -0.711 . . . . 64.010000000000005 110.921 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.604 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.6 m-20 -56.01 -35.72 67.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.071 -0.513 . . . . 74.430000000000007 110.624 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.54 -37.95 65.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 72.430000000000007 111.122 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -74.13 -22.36 59.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.918 0.389 . . . . 73.439999999999998 110.849 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -79.71 -12.71 59.79 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.185 0.517 . . . . 71.319999999999993 109.872 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.604 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 78.1 mm-40 -81.9 -4.85 57.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.97 -0.559 . . . . 54.409999999999997 110.328 175.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.573 ' HB3' HG13 ' A' ' 27' ' ' ILE . 0.2 OUTLIER -80.03 135.01 36.26 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.256 0.55 . . . . 70.129999999999995 110.61 -176.706 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.402 ' H ' HG22 ' A' ' 25' ' ' THR . 3.4 t -74.98 -36.39 62.03 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.228 -0.896 . . . . 70.129999999999995 111.84 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.58 -23.56 56.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 74.349999999999994 111.602 -174.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.573 HG13 ' HB3' ' A' ' 24' ' ' ASN . 2.5 mt -97.12 163.43 2.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.867 0.365 . . . . 70.109999999999999 110.262 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -119.8 163.52 17.37 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.845 -0.616 . . . . 72.099999999999994 109.392 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -54.65 -32.21 58.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.933 0.397 . . . . 73.030000000000001 111.509 -176.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.54 -42.21 99.72 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.232 -0.508 . . . . 65.540000000000006 113.473 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HB2' HG22 ' A' ' 27' ' ' ILE . 21.0 mm-40 -73.04 -37.82 66.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.127 0.463 . . . . 72.109999999999999 111.221 -173.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -69.12 -36.99 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.193 0.52 . . . . 73.349999999999994 110.657 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 m -74.94 -40.01 61.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.091 0.472 . . . . 43.310000000000002 110.705 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.95 -30.33 63.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 73.219999999999999 111.867 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.494 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 11.0 p -66.98 -30.75 70.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.6 0.238 . . . . 74.0 110.727 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.548 ' CD1' HD12 ' B' ' 214' ' ' LEU . 4.9 t80 -66.16 -33.58 76.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.16 0.505 . . . . 63.310000000000002 109.772 177.002 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.544 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.8 ttm -70.54 -47.49 60.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.861 -0.609 . . . . 74.129999999999995 111.104 178.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -63.3 -37.89 89.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.931 0.396 . . . . 72.340000000000003 110.616 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.95 -36.8 84.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.197 -0.456 . . . . 72.120000000000005 111.196 179.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.605 HD21 ' SD ' ' B' ' 237' ' ' MET . 52.3 tp -66.62 -32.4 73.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.001 0.429 . . . . 63.310000000000002 110.022 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -66.91 -46.25 75.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.795 -0.639 . . . . 54.329999999999998 110.704 177.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.3 mtp180 -69.05 -25.11 64.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.896 0.379 . . . . 64.010000000000005 110.949 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.411 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 10.5 t80 -84.29 -45.03 13.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 72.349999999999994 111.057 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -68.51 -28.39 66.96 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.081 0.4 . . . . 54.399999999999999 112.081 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.14 60.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.998 0.428 . . . . 72.420000000000002 111.054 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.411 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 22.3 t90 -66.94 -17.67 65.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.639 0.733 . . . . 72.299999999999997 110.047 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.433 ' CZ ' HG22 ' B' ' 229' ' ' THR . 83.0 m-85 -93.3 0.32 56.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.761 -0.654 . . . . 64.450000000000003 111.156 177.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -73.46 -37.05 53.92 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.454 -0.879 . . . . 25.239999999999998 111.323 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -73.03 -0.21 13.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.954 0.407 . . . . 61.409999999999997 111.574 -177.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.7 t -123.53 17.55 9.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.338 0.59 . . . . 73.230000000000004 109.486 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.9 t -93.93 -31.43 14.29 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.813 -0.63 . . . . 63.509999999999998 110.867 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.712 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -143.29 -174.29 4.17 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 120.947 0.403 . . . . 70.329999999999998 111.368 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.678 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 7.7 pt-20 -98.54 -41.4 7.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.573 -0.74 . . . . 54.32 111.383 -173.233 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 82.7 p -120.93 161.84 20.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.094 -0.336 . . . . 70.420000000000002 110.094 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 22.2 ptmt -72.88 -34.57 66.78 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.918 -0.313 . . . . 74.230000000000004 110.538 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.14 -31.99 73.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.168 -0.469 . . . . 71.430000000000007 110.386 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.666 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 92.0 mt-30 -90.48 -37.72 13.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.007 -0.542 . . . . 73.150000000000006 110.464 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.462 ' HE2' ' CG1' ' B' ' 285' ' ' ILE . 10.5 ttt -61.81 -42.41 98.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.288 -0.414 . . . . 71.340000000000003 110.988 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.85 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.001 -0.545 . . . . 64.430000000000007 110.991 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.07 -6.73 58.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 51.399999999999999 111.27 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.712 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 30.2 mmmt -108.56 4.37 23.99 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 116.486 -0.325 . . . . 73.409999999999997 110.79 -178.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 65' ' ' MET . 18.3 ptpt -53.72 -45.05 70.35 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.338 0.399 . . . . 75.420000000000002 111.017 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 8.5 tp60 -79.9 -14.18 58.82 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.882 -0.327 . . . . 64.209999999999994 110.654 -176.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -93.37 -6.67 46.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.393 -0.367 . . . . 72.230000000000004 110.929 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 20.5 ptp -106.39 -25.05 12.07 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.323 -0.621 . . . . 74.319999999999993 109.323 169.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.516 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 82.2 mtp -94.02 -0.47 55.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.449 -0.796 . . . . 65.349999999999994 112.498 -175.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.26 -33.08 59.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.7 0.762 . . . . 72.230000000000004 109.34 -175.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.648 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 10.8 m-85 -84.27 -16.14 44.21 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.754 -1.112 . . . . 71.310000000000002 110.913 175.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.63 ' CD2' HD21 ' B' ' 277' ' ' LEU . 13.8 m-30 -73.66 -42.21 61.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.263 -0.426 . . . . 61.299999999999997 109.981 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -74.72 -56.71 4.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.279 -0.569 . . . . 61.140000000000001 109.804 170.485 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -102.67 83.73 2.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.09 -0.504 . . . . 64.310000000000002 112.354 -171.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.648 ' HB2' ' O ' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -164.16 -36.93 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.092 -0.504 . . . . 74.299999999999997 111.059 169.821 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.436 ' HE2' ' HG ' ' B' ' 240' ' ' LEU . 0.1 OUTLIER -86.87 7.84 25.5 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.834 0.826 . . . . 74.230000000000004 108.838 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.429 ' HE2' HE22 ' B' ' 263' ' ' GLN . 47.6 tttm -62.64 -54.52 38.33 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.318 -1.31 . . . . 75.109999999999999 110.172 175.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -58.92 -35.57 73.3 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.147 -0.479 . . . . 72.019999999999996 110.625 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.408 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 50.6 mtt -67.28 -36.75 82.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.617 -0.719 . . . . 74.010000000000005 109.974 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 0.9 OUTLIER -75.47 -40.9 56.8 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.264 -0.88 . . . . 64.0 110.224 -178.442 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.414 ' N ' ' HE1' ' B' ' 266' ' ' MET . 3.8 m-20 -53.71 -38.94 64.78 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.315 0.579 . . . . 72.209999999999994 110.175 174.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -31.57 71.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.038 -0.983 . . . . 61.509999999999998 111.523 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.519 HD21 ' HG2' ' B' ' 242' ' ' ARG . 42.8 m-80 -85.09 -32.5 22.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.741 -0.466 . . . . 75.530000000000001 109.741 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.502 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.6 mmt -62.39 -62.17 1.94 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 61.399999999999999 110.475 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 24.6 mm-40 -54.1 -31.7 52.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 64.420000000000002 111.334 -178.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.45 -46.44 80.34 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.346 0.404 . . . . 60.009999999999998 111.328 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -82.53 -28.98 30.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 60.350000000000001 110.695 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.518 HG21 ' HB2' ' B' ' 259' ' ' GLN . 87.3 mt -67.91 -53.48 30.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 71.439999999999998 111.549 -178.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.4 pt-20 -65.32 -25.69 67.72 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.788 0.328 . . . . 73.319999999999993 111.093 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.8 m-80 -102.83 14.94 30.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.553 -0.294 . . . . 72.349999999999994 111.212 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.545 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 62.1 t80 -53.24 -53.83 45.08 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.025 0.203 . . . . 75.349999999999994 111.328 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--N 1.326 -0.448 0 CA-C-O 120.834 0.349 . . . . 73.040000000000006 110.329 -177.06 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 110.661 -0.125 . . . . 75.140000000000001 110.661 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.02 -70.09 0.21 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.484 -0.562 . . . . 65.340000000000003 109.484 170.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -142.56 9.6 1.81 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.903 0.859 . . . . 62.030000000000001 109.124 174.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.586 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -124.58 170.37 10.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 74.530000000000001 111.875 -171.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.494 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -86.59 38.04 0.77 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.423 -0.808 . . . . 75.129999999999995 112.061 -175.64 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.586 ' CE2' ' HB3' ' B' ' 206' ' ' ALA . 65.0 m-85 -52.63 -55.71 20.54 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.687 0.254 . . . . 71.400000000000006 111.687 -177.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.69 -18.46 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.066 -0.515 . . . . 70.209999999999994 112.338 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -86.79 -54.49 4.33 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.146 -0.222 . . . . 72.310000000000002 110.662 178.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.651 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.1 -28.32 51.68 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.432 0.53 . . . . 70.129999999999995 112.432 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 12.5 t -70.34 -16.4 62.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 120.759 -0.376 . . . . 64.129999999999995 111.264 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 36.8 mt-10 -82.96 -29.23 29.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.837 -0.801 . . . . 74.209999999999994 108.837 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.0 -44.8 79.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.903 -1.044 . . . . 74.219999999999999 108.95 176.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.62 -27.39 33.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.39 -0.823 . . . . 61.32 110.512 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.0 OUTLIER -57.52 -38.63 74.99 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.259 -0.428 . . . . 40.450000000000003 110.982 -179.445 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.6 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -70.16 -42.59 72.31 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.224 -0.658 . . . . 71.420000000000002 109.224 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 218' ' ' ALA . . . . . 0.474 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -60.03 -42.43 94.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.058 -0.519 . . . . 63.420000000000002 110.731 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.568 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.4 m-20 -56.24 -34.22 66.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.235 -0.439 . . . . 62.399999999999999 110.587 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.33 -34.08 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.007 -0.542 . . . . 73.349999999999994 111.297 -178.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -75.39 -25.91 58.01 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.213 0.53 . . . . 72.219999999999999 110.495 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 222' ' ' ASN . . . . . 0.427 ' HA ' HG21 ' B' ' 232' ' ' VAL . 59.9 t30 -68.27 -21.4 64.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.51 -0.768 . . . . 72.129999999999995 109.125 177.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 60.1 mm-40 -85.32 0.68 51.27 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.383 -0.826 . . . . 62.340000000000003 111.077 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.718 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 2.4 t-20 -78.01 123.15 26.48 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 109.691 -0.485 . . . . 71.129999999999995 109.691 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.3 t -54.98 -26.01 33.77 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.91 -1.041 . . . . 73.540000000000006 113.434 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -105.08 9.05 34.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.381 0.512 . . . . 73.319999999999993 112.381 -173.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.718 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 6.2 mm -108.16 152.14 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.397 0.618 . . . . 75.239999999999995 111.306 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.548 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 32.8 mt-30 -92.11 152.13 20.07 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.143 -0.935 . . . . 54.030000000000001 108.596 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 229' ' ' THR . . . . . 0.433 HG22 ' CZ ' ' A' ' 47' ' ' PHE . 16.8 m -56.46 -38.22 71.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.922 0.392 . . . . 72.209999999999994 110.755 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.28 -0.18 76.78 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.216 -0.516 . . . . 65.340000000000003 113.964 -176.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.548 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 42.1 mt-10 -90.02 -27.42 19.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.862 0.831 . . . . 71.510000000000005 110.406 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 232' ' ' VAL . . . . . 0.474 HG11 ' O ' ' B' ' 218' ' ' ALA . 12.1 t -76.94 -23.94 15.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.741 -0.663 . . . . 75.200000000000003 110.682 -176.696 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.5 p -77.46 -32.61 54.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.368 0.604 . . . . 52.039999999999999 109.806 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.71 65.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.529 -0.759 . . . . 50.200000000000003 111.044 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.459 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 16.8 p -66.86 -37.11 83.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.706 0.288 . . . . 53.299999999999997 110.334 177.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.563 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.13 -37.71 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.424 0.631 . . . . 55.140000000000001 109.323 175.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.605 ' SD ' HD21 ' A' ' 40' ' ' LEU . 10.7 tpt -58.07 -59.77 4.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.924 -1.034 . . . . 54.149999999999999 111.006 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.408 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 13.6 t-105 -59.43 -37.14 77.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 74.209999999999994 111.593 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.08 93.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.374 -0.375 . . . . 71.129999999999995 111.34 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.501 HD13 ' HB3' ' A' ' 36' ' ' PHE . 53.7 tp -68.77 -33.52 74.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.29 -0.263 . . . . 75.420000000000002 110.29 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.434 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.51 -35.42 75.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 71.239999999999995 111.104 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 242' ' ' ARG . . . . . 0.519 ' HG2' HD21 ' A' ' 80' ' ' ASN . 34.5 mtp180 -80.44 -45.87 16.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.181 -0.463 . . . . 72.209999999999994 110.742 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.502 ' HD2' HG23 ' A' ' 15' ' ' ILE . 12.2 t80 -68.52 -40.32 80.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.112 -0.495 . . . . 54.450000000000003 111.315 -174.05 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -64.73 -35.09 79.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.159 0.504 . . . . 71.25 110.931 -175.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -68.4 -2.04 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.871 -0.604 . . . . 64.430000000000007 112.242 -177.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -64.16 -26.92 68.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.218 0.532 . . . . 74.129999999999995 110.115 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -81.76 -5.27 58.0 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.134 -0.354 . . . . 75.319999999999993 111.13 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -71.03 -40.55 62.1 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.643 -0.789 . . . . 53.009999999999998 111.999 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 4.5 p -70.04 -14.25 62.59 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.869 0.322 . . . . 54.140000000000001 111.869 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.0 t -111.19 19.68 18.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.364 0.602 . . . . 72.219999999999999 110.022 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 8.2 t -84.94 -43.79 13.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.032 -0.531 . . . . 72.439999999999998 111.29 -176.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.577 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -143.2 -177.65 5.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.362 0.601 . . . . 75.040000000000006 112.353 -176.01 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.498 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 9.6 pt-20 -92.32 -37.03 12.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.973 -1.012 . . . . 74.329999999999998 111.832 -171.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.7 p -126.47 161.28 28.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.38 -0.23 . . . . 62.509999999999998 110.38 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.545 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 17.0 ptmt -64.14 -39.02 93.12 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 70.200000000000003 111.067 -177.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 256' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' B' ' 255' ' ' LYS . 37.1 mt-10 -59.89 -47.4 85.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.088 0.471 . . . . 75.239999999999995 111.026 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.677 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 88.9 mt-30 -80.48 -30.04 37.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.967 -0.56 . . . . 55.43 110.421 -176.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 14.0 ttt -67.03 -45.04 78.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 73.430000000000007 110.398 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.518 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.2 tt0 -63.03 -32.55 73.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.701 -0.681 . . . . 74.340000000000003 111.064 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -72.9 -11.33 60.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.178 -0.464 . . . . 74.239999999999995 111.055 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -107.1 -4.13 19.22 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 110.059 -0.348 . . . . 74.120000000000005 110.059 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.524 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 36.4 ttpt -52.3 -56.29 15.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.761 -0.654 . . . . 65.219999999999999 110.686 -177.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.429 HE22 ' HE2' ' A' ' 74' ' ' LYS . 15.2 tp60 -64.74 -30.92 71.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 75.209999999999994 111.004 -178.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -70.12 -45.48 66.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.329 -0.396 . . . . 74.219999999999999 111.909 -176.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.524 ' CE ' ' HA ' ' B' ' 262' ' ' LYS . 3.0 ptt? -77.73 -24.43 49.12 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 119.734 -0.786 . . . . 54.420000000000002 109.542 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.474 ' HA ' ' CD2' ' B' ' 269' ' ' TYR . 84.5 mtp -79.61 -13.39 59.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.591 -0.731 . . . . 71.219999999999999 111.431 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.17 -30.07 69.1 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.484 -0.932 . . . . 72.030000000000001 108.484 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.469 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 21.8 m-85 -93.7 -10.22 35.12 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.332 -1.304 . . . . 75.209999999999994 111.486 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.474 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 20.2 m-30 -79.82 -40.73 27.91 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.281 -1.007 . . . . 75.439999999999998 108.281 172.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.474 ' N ' ' HE3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.7 -59.01 3.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.087 -0.506 . . . . 53.100000000000001 110.199 170.026 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.16 83.65 2.0 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.168 0.433 . . . . 75.400000000000006 112.168 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 9.7 mmm180 -154.04 -30.02 0.12 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.972 -0.558 . . . . 72.219999999999999 110.903 166.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.544 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -90.52 6.44 43.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.619 -0.882 . . . . 75.099999999999994 108.619 177.039 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.581 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 85.2 tttt -61.82 -53.5 55.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.564 -1.198 . . . . 74.219999999999999 110.248 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 275' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' B' ' 275' ' ' GLU . 5.2 pt-20 -69.41 -33.61 73.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.055 -0.52 . . . . 53.229999999999997 110.9 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.0 mtt -61.62 -38.93 89.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.608 0.718 . . . . 73.430000000000007 109.706 173.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.63 HD21 ' CD2' ' A' ' 69' ' ' TYR . 22.6 tp -71.37 -46.07 61.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.687 -1.142 . . . . 74.140000000000001 110.786 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.96 -40.23 80.07 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.271 0.558 . . . . 75.409999999999997 110.486 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.54 -30.72 71.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.156 -0.929 . . . . 72.510000000000005 111.196 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -86.31 -29.26 23.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 62.310000000000002 110.508 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.568 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -61.26 -55.42 32.11 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.879 -0.415 . . . . 73.310000000000002 109.879 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.611 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 71.7 mm-40 -52.98 -30.63 36.16 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.515 -0.766 . . . . 45.200000000000003 111.799 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -54.52 -51.36 65.39 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.396 0.435 . . . . 72.219999999999999 111.133 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -80.22 -28.65 38.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.356 -0.384 . . . . 75.310000000000002 111.156 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.568 HG13 ' O ' ' B' ' 281' ' ' MET . 76.3 mt -63.98 -53.56 42.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.823 0.344 . . . . 54.509999999999998 110.895 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.9 pt-20 -63.18 -29.01 70.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.42 -0.355 . . . . 51.240000000000002 111.201 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 287' ' ' ASN . . . . . 0.463 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 61.6 m-80 -102.02 15.37 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.528 -0.305 . . . . 71.099999999999994 111.417 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.449 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 27.0 t80 -53.22 -57.6 9.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.683 0.278 . . . . 73.519999999999996 111.02 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 28.0 t70 . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.297 -0.41 . . . . 70.150000000000006 110.583 -175.985 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.667 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.3 p-10 . . . . . 0 N--CA 1.452 -0.368 0 CA-C-O 121.054 0.454 . . . . 64.120000000000005 110.767 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -83.51 -80.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.993 -0.549 . . . . 74.019999999999996 110.169 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -105.16 -53.74 2.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.07 0.462 . . . . 74.430000000000007 109.94 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.667 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -82.52 161.9 22.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.895 -0.593 . . . . 71.200000000000003 110.808 177.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.471 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -80.41 55.14 2.19 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.895 -0.593 . . . . 73.209999999999994 112.181 -178.252 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -53.02 -42.65 65.86 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.334 -0.394 . . . . 74.329999999999998 111.844 -176.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' HG22 ' A' ' 12' ' ' THR . . . -63.35 -28.39 69.97 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.136 0.421 . . . . 70.109999999999999 112.136 -176.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -80.81 -62.98 1.51 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 121.174 -0.21 . . . . 74.510000000000005 110.608 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.91 -22.41 10.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.778 0.659 . . . . 54.450000000000003 112.778 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 9' ' ' ALA . 1.9 t -70.02 -25.82 63.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.464 0.173 . . . . 64.409999999999997 110.992 -176.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.488 ' CB ' HD11 ' B' ' 217' ' ' LEU . 29.9 mt-10 -76.73 -35.5 57.74 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.373 0.606 . . . . 72.420000000000002 109.401 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.655 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.0 mm? -61.11 -49.81 75.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.612 -1.176 . . . . 71.430000000000007 109.694 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.726 HG23 ' HD1' ' B' ' 243' ' ' TYR . 91.2 mt -63.36 -39.84 86.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.616 -0.72 . . . . 63.450000000000003 110.858 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 tmmt? -62.02 -31.37 71.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.618 -0.719 . . . . 74.0 111.516 -176.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.525 HD12 HD13 ' B' ' 214' ' ' LEU . 3.0 tm? -64.68 -42.54 95.28 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.981 -0.748 . . . . 51.43 108.981 177.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.72 -30.79 71.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.403 -0.817 . . . . 41.030000000000001 110.948 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.437 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 4.5 m-20 -62.57 -35.26 78.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.212 -0.449 . . . . 75.310000000000002 110.749 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -70.57 -23.25 62.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.197 -0.456 . . . . 53.229999999999997 111.23 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -88.17 -27.29 21.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.247 0.546 . . . . 75.209999999999994 110.351 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -78.26 0.51 24.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 73.150000000000006 110.33 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 48.8 mt-30 -77.46 -11.81 59.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 74.109999999999999 111.197 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.432 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.5 t-20 -66.04 114.14 4.98 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.462 -0.57 . . . . 75.109999999999999 109.462 178.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.437 ' H ' HG22 ' A' ' 25' ' ' THR . 3.8 t -77.45 58.06 1.64 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.318 -0.856 . . . . 64.239999999999995 112.272 -172.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -178.0 -22.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 75.230000000000004 111.441 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.432 HG13 ' HB3' ' A' ' 24' ' ' ASN . 9.7 mt -84.36 148.77 4.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 72.450000000000003 110.31 -177.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.709 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -72.76 145.38 47.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 61.140000000000001 109.704 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.0 m -63.39 -25.26 68.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.252 0.549 . . . . 75.340000000000003 109.843 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.03 -17.37 78.59 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 115.462 -0.79 . . . . 73.409999999999997 112.823 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.709 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 16.3 mm-40 -79.04 -22.62 45.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.417 0.627 . . . . 74.019999999999996 109.567 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -83.53 -42.44 17.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.417 -0.811 . . . . 74.010000000000005 110.088 179.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 p -62.1 -35.94 80.22 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.988 0.423 . . . . 73.140000000000001 110.177 176.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.13 -33.33 75.75 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.978 -0.555 . . . . 75.409999999999997 110.786 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.7 m -68.46 -36.35 78.88 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.509 -0.552 . . . . 72.519999999999996 109.509 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.655 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.7 t80 -69.94 -35.05 74.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.472 -0.785 . . . . 63.219999999999999 109.49 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' MET . . . . . 1.013 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.8 tpt -62.35 -56.79 14.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.08 -0.964 . . . . 73.030000000000001 110.563 179.128 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.406 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.637 -0.71 . . . . 72.140000000000001 111.335 177.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.05 99.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.404 -0.362 . . . . 60.420000000000002 111.102 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.9 -38.51 91.25 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 110.021 -0.362 . . . . 74.219999999999999 110.021 176.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.429 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -61.71 -45.86 92.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.233 -0.439 . . . . 72.129999999999995 111.041 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG3' ' OD1' ' B' ' 280' ' ' ASN . 39.9 ttt180 -74.27 -18.69 60.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.383 -0.371 . . . . 74.319999999999993 110.923 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.482 ' HD2' HG23 ' B' ' 215' ' ' ILE . 14.2 t80 -90.57 -35.35 15.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.136 0.494 . . . . 75.25 110.346 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -74.85 -39.24 61.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.915 -0.584 . . . . 70.150000000000006 111.185 -175.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.474 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -65.59 -18.21 65.15 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.035 0.445 . . . . 62.439999999999998 111.531 -178.202 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TRP . . . . . 0.572 ' CH2' HG21 ' B' ' 229' ' ' THR . 16.7 t90 -63.67 -23.68 67.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.652 -0.703 . . . . 73.099999999999994 110.466 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.469 ' O ' HG22 ' A' ' 50' ' ' THR . 42.6 m-85 -93.61 9.71 35.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.219 -0.446 . . . . 72.5 111.075 178.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -76.74 -24.0 68.37 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.093 -1.051 . . . . 71.230000000000004 110.633 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.982 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 14.8 m -72.38 -12.96 61.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.186 -0.507 . . . . 71.450000000000003 111.843 -177.677 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.8 t -104.14 6.77 35.98 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.292 0.568 . . . . 75.099999999999994 110.612 -178.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.6 m -86.77 -24.78 24.96 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 112.935 0.717 . . . . 62.32 112.935 -175.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.547 ' HD1' ' H ' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -150.72 -172.31 4.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 122.095 -0.378 . . . . 63.049999999999997 111.22 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.547 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 9.6 pt-20 -110.85 -35.61 5.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.223 -0.444 . . . . 64.109999999999999 112.197 -173.414 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.3 p -115.15 155.56 26.9 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.094 -0.336 . . . . 53.210000000000001 110.094 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.631 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 21.9 ptmt -66.65 -37.93 85.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.738 0.304 . . . . 62.509999999999998 110.816 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -69.69 -27.67 65.21 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.07 -0.514 . . . . 73.120000000000005 111.32 -174.093 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.617 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 96.8 mt-30 -94.05 -32.47 13.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.448 -0.342 . . . . 74.549999999999997 110.652 178.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.982 ' HE1' ' HA ' ' A' ' 49' ' ' SER . 16.6 ttp -72.57 -35.53 67.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.991 0.424 . . . . 74.010000000000005 110.497 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.57 ' HB2' HG21 ' B' ' 285' ' ' ILE . 35.2 tt0 -62.1 -37.55 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 75.140000000000001 110.654 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.69 -2.2 25.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.912 -0.585 . . . . 71.209999999999994 110.998 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 32.1 mmmt -110.81 0.39 17.26 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 116.32 -0.4 . . . . 74.230000000000004 110.953 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.76 ' HG3' ' H ' ' A' ' 63' ' ' GLN . 12.9 ptpt -54.97 -56.9 14.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.836 0.35 . . . . 62.240000000000002 110.367 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.76 ' H ' ' HG3' ' A' ' 62' ' ' LYS . 5.7 tp-100 -74.49 -20.13 60.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.249 -0.432 . . . . 73.030000000000001 109.843 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -79.69 -36.26 37.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.754 -0.657 . . . . 74.340000000000003 111.434 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 20.8 ptp -79.27 -27.01 42.29 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.112 -1.069 . . . . 55.049999999999997 108.112 178.167 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.42 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 76.7 mtp -79.36 -17.46 54.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.864 -1.062 . . . . 65.439999999999998 110.477 175.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -58.56 -35.01 71.68 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.318 0.58 . . . . 53.219999999999999 110.819 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.745 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 14.8 p90 -108.92 -5.69 16.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.75 -0.659 . . . . 75.109999999999999 110.576 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.683 ' HD2' HD21 ' B' ' 277' ' ' LEU . 2.2 m-30 -60.52 -51.95 67.27 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 110.469 -0.197 . . . . 75.349999999999994 110.469 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' MET . . . . . 1.038 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.25 -43.36 70.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.629 0.728 . . . . 75.450000000000003 109.599 172.924 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.0 33.98 0.86 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.798 -1.092 . . . . 71.25 112.066 -171.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.745 ' HG3' ' O ' ' A' ' 68' ' ' TYR . 35.2 mtp180 -105.85 -43.2 4.94 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.626 -0.671 . . . . 71.140000000000001 110.958 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.829 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -91.57 6.93 43.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.817 -0.353 . . . . 74.239999999999995 111.127 -175.179 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -60.88 -53.16 60.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 74.200000000000003 110.461 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -57.52 -34.32 68.99 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.192 0.52 . . . . 60.229999999999997 110.882 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.8 mtt -68.28 -37.1 80.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 74.430000000000007 109.922 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.557 ' HB3' ' CE ' ' B' ' 266' ' ' MET . 0.4 OUTLIER -73.0 -43.4 62.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.194 -0.912 . . . . 75.120000000000005 110.407 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.417 ' N ' ' HE1' ' B' ' 266' ' ' MET . 3.3 m-20 -55.31 -39.02 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.449 0.643 . . . . 74.239999999999995 110.634 178.156 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.69 -22.49 53.88 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.121 -0.945 . . . . 75.409999999999997 112.269 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.478 ' OD1' ' HG3' ' B' ' 242' ' ' ARG . 20.2 m-80 -94.29 -8.67 38.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.446 -0.502 . . . . 63.409999999999997 111.854 -174.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.456 ' HE3' ' HA ' ' B' ' 245' ' ' ALA . 44.2 mtt -88.94 -175.24 4.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.216 0.532 . . . . 74.120000000000005 111.278 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.665 ' HA ' HD12 ' A' ' 85' ' ' ILE . 36.2 mt-10 69.8 -5.1 1.29 Allowed 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.668 -1.151 . . . . 62.020000000000003 113.207 177.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.02 -56.97 15.1 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.074 0.464 . . . . 74.329999999999998 110.703 178.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -73.78 -21.73 60.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 55.32 110.904 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.7 mt -67.52 -57.79 8.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.404 -0.362 . . . . 65.120000000000005 110.407 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 23.9 pt-20 -62.8 -26.43 68.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 72.019999999999996 111.292 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -98.49 1.45 46.67 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.996 0.369 . . . . 41.210000000000001 111.996 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -59.23 -40.57 86.29 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.981 -0.377 . . . . 62.25 109.981 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.62 -0.718 . . . . 74.340000000000003 109.962 174.875 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.562 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.0 p-10 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 110.111 -0.329 . . . . 62.119999999999997 110.111 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -85.69 -113.49 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.418 -0.356 . . . . 72.439999999999998 110.512 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -91.89 -13.7 30.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.857 0.837 . . . . 50.25 109.184 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -107.55 150.44 26.85 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.101 -0.954 . . . . 61.140000000000001 110.471 176.351 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.455 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.1 OUTLIER -76.14 50.93 0.64 Allowed 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.939 -1.028 . . . . 63.240000000000002 112.486 -177.905 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.473 ' CZ ' ' HB3' ' B' ' 206' ' ' ALA . 63.5 m-85 -53.87 -44.28 70.26 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.725 0.298 . . . . 73.519999999999996 111.536 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -72.08 -9.04 57.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.147 -0.479 . . . . 74.129999999999995 111.86 -175.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 74.1 mtt180 -99.08 -59.31 1.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.928 -0.397 . . . . 71.450000000000003 109.928 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.736 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.12 -23.72 22.41 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.868 0.692 . . . . 71.209999999999994 112.868 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 9.3 t -65.05 -25.43 67.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.499 0.185 . . . . 74.439999999999998 111.499 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.484 ' HB2' HD11 ' A' ' 17' ' ' LEU . 39.1 mt-10 -80.52 -26.39 38.13 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.359 0.6 . . . . 61.210000000000001 109.845 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.736 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.2 mm? -68.18 -47.77 67.07 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.061 -0.972 . . . . 75.230000000000004 109.341 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.482 HG23 ' HD2' ' A' ' 43' ' ' TYR . 82.1 mt -66.5 -33.01 60.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-N 115.839 -0.619 . . . . 63.229999999999997 110.415 175.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.436 ' HE2' ' HB3' ' B' ' 216' ' ' LYS . 5.0 tmmm? -57.84 -36.37 72.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.529 -0.76 . . . . 73.049999999999997 110.797 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.488 HD11 ' CB ' ' A' ' 13' ' ' GLU . 2.5 tm? -66.95 -41.68 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.668 -0.493 . . . . 74.25 109.668 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.39 -31.74 69.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 64.549999999999997 110.94 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -59.79 -33.32 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.141 -0.481 . . . . 62.149999999999999 111.12 178.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.06 -24.75 47.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.126 -0.488 . . . . 72.209999999999994 111.764 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -91.01 -17.06 26.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.395 0.617 . . . . 74.319999999999993 110.114 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -85.92 8.79 18.98 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.259 -0.882 . . . . 74.129999999999995 110.257 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -84.18 10.05 11.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.947 -0.569 . . . . 71.540000000000006 111.217 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -88.41 108.27 19.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.955 0.407 . . . . 73.209999999999994 110.763 177.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -74.39 -25.23 59.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.725 -0.671 . . . . 70.040000000000006 110.885 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -82.2 -6.0 58.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.355 -0.384 . . . . 74.510000000000005 111.781 -176.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.743 HG22 ' H ' ' B' ' 228' ' ' GLN . 2.4 mt -124.12 179.7 2.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.84 -0.43 . . . . 74.129999999999995 109.84 -178.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.743 ' H ' HG22 ' B' ' 227' ' ' ILE . 2.3 mp0 -103.82 158.39 16.42 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.822 -0.436 . . . . 52.420000000000002 109.822 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 229' ' ' THR . . . . . 0.572 HG21 ' CH2' ' A' ' 46' ' ' TRP . 25.4 m -67.08 -16.44 64.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.212 0.53 . . . . 72.420000000000002 110.656 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -62.85 -33.36 86.78 Favored Glycine 0 CA--C 1.521 0.449 0 CA-C-N 115.603 -0.726 . . . . 70.230000000000004 113.733 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -72.45 -26.89 62.0 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 117.573 0.687 . . . . 71.349999999999994 110.6 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.7 t -72.06 -46.76 57.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.138 -0.483 . . . . 75.200000000000003 110.129 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 3.2 p -62.49 -34.52 77.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 61.32 110.366 176.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -69.81 -35.9 75.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.912 -0.585 . . . . 72.530000000000001 111.255 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 59.8 m -67.04 -35.38 79.74 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.09 0.471 . . . . 44.399999999999999 109.889 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' A' ' 14' ' ' LEU . 8.5 t80 -67.47 -38.71 84.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.734 -0.666 . . . . 64.340000000000003 109.69 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.829 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.6 ttm -65.97 -48.22 71.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.539 -0.755 . . . . 72.140000000000001 111.42 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.471 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 17.3 t-105 -61.15 -40.53 94.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 71.530000000000001 110.463 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.558 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.76 -42.16 99.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.882 -0.599 . . . . 55.43 110.997 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.725 HD21 ' SD ' ' A' ' 37' ' ' MET . 49.6 tp -60.75 -40.52 92.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 71.510000000000005 110.741 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.4 95.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.099 -0.501 . . . . 64.010000000000005 110.671 178.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 242' ' ' ARG . . . . . 0.478 ' HG3' ' OD1' ' A' ' 80' ' ' ASN . 64.3 ttt180 -67.08 -32.57 73.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.572 -0.74 . . . . 74.420000000000002 110.608 -179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.726 ' HD1' HG23 ' A' ' 15' ' ' ILE . 23.0 t80 -77.52 -40.06 44.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 65.340000000000003 110.992 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -73.2 -24.49 60.53 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.772 0.286 . . . . 74.420000000000002 111.772 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.493 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -68.55 -19.77 64.51 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.247 0.546 . . . . 74.400000000000006 110.958 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.1 t90 -59.88 -33.46 71.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.241 -0.89 . . . . 64.200000000000003 111.054 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -72.84 -6.52 45.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.854 -0.612 . . . . 61.299999999999997 112.502 -171.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -59.8 -30.99 70.47 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.011 -1.09 . . . . 64.140000000000001 110.916 172.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 249' ' ' SER . . . . . 0.515 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 6.6 m -66.36 -16.29 63.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.724 0.41 . . . . 74.140000000000001 111.741 -177.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -116.43 17.33 15.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.067 0.46 . . . . 35.340000000000003 110.808 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 39.8 t -81.34 -56.55 3.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.031 -0.531 . . . . 71.230000000000004 110.655 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 5.2 m-85 -137.69 178.76 6.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.083 0.468 . . . . 74.340000000000003 112.188 -177.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 8.9 pt-20 -94.76 -33.75 12.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.36 -0.836 . . . . 75.209999999999994 110.985 -173.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.425 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 75.4 p -114.21 154.34 28.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.242 -0.435 . . . . 72.349999999999994 110.211 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.505 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 21.3 ptmt -70.03 -29.8 66.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.816 0.341 . . . . 74.439999999999998 110.292 -178.215 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 256' ' ' GLU . . . . . 0.425 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.9 mp0 -55.17 -48.43 73.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.685 -0.689 . . . . 44.219999999999999 110.415 177.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.702 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 92.1 mt-30 -80.54 -41.82 23.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.73 -0.668 . . . . 75.420000000000002 109.986 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.515 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.1 ttt -55.18 -44.51 75.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.602 -0.726 . . . . 74.109999999999999 111.483 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.569 ' HA ' HD13 ' A' ' 85' ' ' ILE . 36.0 tt0 -64.75 -40.98 96.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.515 . . . . 73.140000000000001 111.432 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.74 -5.96 33.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 53.409999999999997 111.685 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.702 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 27.6 mmmt -106.75 4.73 27.98 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.247 -0.279 . . . . 72.450000000000003 110.247 -177.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.474 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.6 ptpt -51.38 -46.0 62.66 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.431 0.457 . . . . 71.019999999999996 110.788 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.474 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 5.1 tp-100 -84.27 -18.03 37.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.766 0.317 . . . . 75.329999999999998 110.521 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -85.24 -30.56 23.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.525 . . . . 70.540000000000006 111.26 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -81.75 -29.0 33.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.342 -0.984 . . . . 51.329999999999998 108.342 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.557 ' CE ' ' HB3' ' A' ' 77' ' ' LEU . 71.9 mtp -87.87 11.23 16.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.864 -1.062 . . . . 53.32 110.462 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -75.0 -38.03 61.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 74.219999999999999 111.027 -177.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.595 ' HA ' ' OD2' ' B' ' 271' ' ' ASP . 42.7 p90 -114.07 -4.21 13.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.884 -0.598 . . . . 61.420000000000002 110.818 -175.26 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.434 ' O ' ' HE1' ' A' ' 37' ' ' MET . 3.6 m-30 -56.68 -52.46 64.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 121.02 -0.272 . . . . 73.420000000000002 110.607 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 270' ' ' MET . . . . . 1.038 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.55 -50.85 52.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.619 0.574 . . . . 71.329999999999998 110.888 177.773 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 271' ' ' ASP . . . . . 0.595 ' OD2' ' HA ' ' B' ' 268' ' ' TYR . 2.9 p30 -85.47 22.07 1.63 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.643 . . . . 74.129999999999995 112.647 -171.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 33.3 mtp180 -82.03 -34.98 29.29 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.539 -0.464 . . . . 71.430000000000007 110.259 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 1.013 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.7 12.93 34.14 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.445 -0.502 . . . . 54.229999999999997 109.75 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.467 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 86.5 tttt -58.49 -54.87 42.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.726 -0.67 . . . . 55.310000000000002 110.261 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.38 -31.76 72.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.573 -0.739 . . . . 74.349999999999994 111.281 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 58.2 mtt -71.49 -36.28 71.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.927 -0.579 . . . . 61.130000000000003 110.389 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.683 HD21 ' HD2' ' A' ' 69' ' ' TYR . 38.0 tp -70.35 -41.21 73.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.292 -0.867 . . . . 71.219999999999999 110.127 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -60.9 -45.26 95.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.782 -0.644 . . . . 75.430000000000007 110.408 178.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -66.26 -17.08 64.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.239 -0.891 . . . . 63.240000000000002 112.235 -176.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 280' ' ' ASN . . . . . 0.402 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 36.4 m-80 -102.13 -2.08 30.14 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.879 -0.328 . . . . 73.299999999999997 111.392 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.474 ' HG2' ' HB1' ' A' ' 45' ' ' ALA . 46.2 mtt -91.54 -177.25 4.75 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.862 -0.335 . . . . 73.319999999999993 110.428 174.128 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.732 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 46.1 mt-10 67.38 -3.36 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.67 -0.696 . . . . 72.239999999999995 112.598 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.29 -58.75 5.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.07 0.462 . . . . 74.439999999999998 110.398 176.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -84.96 -3.13 58.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.778 -0.646 . . . . 72.420000000000002 110.996 177.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.732 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 63.1 mt -85.01 -59.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.724 0.297 . . . . 73.120000000000005 110.437 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -67.11 -18.44 65.31 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.968 0.413 . . . . 70.109999999999999 110.561 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -107.01 6.92 29.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 111.011 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 60.7 t80 -59.19 -48.89 79.93 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.852 -0.425 . . . . 74.400000000000006 109.852 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 115.566 -0.743 . . . . 45.310000000000002 110.443 178.132 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.4 p-10 . . . . . 0 N--CA 1.451 -0.423 0 N-CA-C 108.422 -0.955 . . . . 51.240000000000002 108.422 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -84.14 -66.06 0.94 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.732 0.301 . . . . 71.209999999999994 111.416 -174.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -124.22 -41.44 2.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.457 -0.571 . . . . 74.239999999999995 109.457 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.76 157.25 31.79 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.551 -0.75 . . . . 74.540000000000006 110.635 177.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.502 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.31 43.41 0.72 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.092 -0.958 . . . . 64.099999999999994 112.468 -175.122 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -52.48 -51.42 59.44 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.885 0.374 . . . . 73.439999999999998 111.589 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.412 ' H ' ' HB3' ' A' ' 3' ' ' ASN . . . -69.35 -5.57 24.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 53.340000000000003 111.759 -177.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.502 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 27.6 mmt180 -100.72 -58.88 1.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.313 -0.254 . . . . 75.530000000000001 110.313 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.739 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -52.19 -25.54 9.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.462 0.542 . . . . 62.520000000000003 112.462 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -62.89 -24.77 67.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.61 -0.268 . . . . 74.519999999999996 111.062 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.571 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.0 mt-10 -86.24 -28.96 23.5 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-O 121.108 0.48 . . . . 73.510000000000005 110.024 -178.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.739 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -64.26 -47.15 80.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.587 -0.733 . . . . 70.219999999999999 109.613 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.427 HG13 ' HB1' ' B' ' 239' ' ' ALA . 62.0 mt -69.51 -28.45 37.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.931 -0.577 . . . . 64.530000000000001 110.275 176.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 13' ' ' GLU . 2.7 mmmt -63.91 -28.69 70.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.543 . . . . 72.299999999999997 111.296 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.617 HD12 HD13 ' B' ' 214' ' ' LEU . 2.7 tm? -78.27 -31.13 48.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.259 -0.645 . . . . 62.210000000000001 109.259 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.75 -44.06 74.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.719 -0.673 . . . . 71.319999999999993 109.404 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.515 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 6.5 m-20 -58.21 -27.66 64.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.27 -0.877 . . . . 73.109999999999999 110.643 175.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -75.27 -32.39 61.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 75.239999999999995 110.813 -176.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -86.24 -20.4 28.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.426 0.632 . . . . 74.239999999999995 109.75 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -74.09 -10.05 59.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.142 -0.935 . . . . 73.409999999999997 109.574 176.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 80.3 mt-30 -77.48 -10.29 59.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.557 -0.747 . . . . 73.439999999999998 110.799 177.54 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.26 103.9 2.97 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.076 -0.713 . . . . 75.230000000000004 109.076 178.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -46.8 -44.73 19.45 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.528 0.936 . . . . 72.120000000000005 113.528 -173.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.57 -4.02 54.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.321 0.489 . . . . 74.540000000000006 112.321 -173.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.6 mt -104.0 151.4 6.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.649 -0.5 . . . . 71.140000000000001 109.649 177.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -98.97 160.15 14.46 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.177 -0.465 . . . . 74.049999999999997 110.382 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.08 -33.4 65.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.935 -0.575 . . . . 70.219999999999999 110.744 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.74 -33.65 83.55 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.484 -0.78 . . . . 54.100000000000001 113.828 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -74.63 -26.25 59.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.734 0.767 . . . . 73.439999999999998 110.365 -174.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -76.16 -32.84 23.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.671 -0.695 . . . . 75.040000000000006 110.305 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.577 ' O ' ' HG3' ' A' ' 37' ' ' MET . 92.1 p -72.4 -12.59 61.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.293 -0.412 . . . . 70.299999999999997 110.258 177.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -90.86 -39.72 12.16 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.121 -0.491 . . . . 73.230000000000004 110.798 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.45 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 5.6 p -67.41 -31.01 70.93 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.162 0.506 . . . . 74.340000000000003 110.276 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.644 ' HB3' HD13 ' B' ' 240' ' ' LEU . 2.6 t80 -68.52 -29.38 67.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 71.349999999999994 110.378 178.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.658 ' HG2' HD21 ' B' ' 240' ' ' LEU . 51.0 mtp -77.52 -45.69 24.71 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.719 -0.219 . . . . 75.340000000000003 110.635 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.0 t-105 -60.67 -38.92 86.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 74.439999999999998 110.138 176.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.454 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.49 -47.89 77.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.584 -0.735 . . . . 63.119999999999997 110.926 177.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.595 HD21 ' HG2' ' B' ' 237' ' ' MET . 51.2 tp -63.25 -40.5 97.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.714 0.292 . . . . 50.439999999999998 110.514 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.507 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -54.69 -46.68 74.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.765 -0.652 . . . . 51.119999999999997 111.496 -178.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -13.13 51.35 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.211 -0.595 . . . . 74.439999999999998 110.97 -177.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -80.94 -35.08 32.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.028 -0.73 . . . . 73.010000000000005 109.028 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -67.73 -35.13 78.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.888 -0.596 . . . . 65.099999999999994 109.535 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.579 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -71.83 -17.81 62.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.656 -0.702 . . . . 72.109999999999999 111.529 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.2 t90 -63.4 -22.54 66.94 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.17 0.51 . . . . 75.109999999999999 110.224 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -89.32 -4.07 58.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 71.040000000000006 111.373 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.99 -37.69 60.27 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.603 -0.808 . . . . 32.229999999999997 112.124 -179.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.474 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 33.5 p -67.48 -23.18 65.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.895 0.379 . . . . 74.109999999999999 111.441 -176.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.9 t -100.19 11.28 39.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.15 0.5 . . . . 73.219999999999999 110.278 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 t -85.88 -29.53 23.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.422 -0.354 . . . . 54.299999999999997 110.685 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.834 ' HE2' ' HE3' ' A' ' 61' ' ' LYS . 0.3 OUTLIER -145.46 -175.21 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.208 0.447 . . . . 72.409999999999997 112.208 -179.721 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.54 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.7 pt-20 -99.1 -32.28 11.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.418 -0.81 . . . . 72.430000000000007 112.162 -172.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.54 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.6 p -128.59 156.79 42.8 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 116.241 -0.436 . . . . 65.040000000000006 109.911 -178.096 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.624 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.6 ptmm? -69.05 -27.52 65.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.842 0.353 . . . . 72.239999999999995 110.641 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -63.45 -49.15 74.79 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.875 -0.602 . . . . 74.310000000000002 110.294 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.639 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 97.0 mt-30 -79.71 -36.97 36.69 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.813 -0.63 . . . . 62.310000000000002 110.31 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.484 ' HE1' HG12 ' B' ' 285' ' ' ILE . 14.3 ttt -60.2 -40.42 90.03 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.04 -0.527 . . . . 62.539999999999999 111.219 178.866 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.666 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.3 tt0 -63.7 -30.86 71.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.027 -0.533 . . . . 73.140000000000001 111.231 -177.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.67 -9.23 59.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.04 0.448 . . . . 50.039999999999999 111.042 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.834 ' HE3' ' HE2' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -105.0 -5.46 20.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.213 -0.449 . . . . 71.510000000000005 110.338 -176.809 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HD2' ' N ' ' A' ' 63' ' ' GLN . 0.6 OUTLIER -51.86 -54.91 23.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 61.130000000000003 110.866 -177.603 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.506 ' N ' ' HD2' ' A' ' 62' ' ' LYS . 11.0 tp60 -75.31 -13.13 60.4 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.098 -0.501 . . . . 75.409999999999997 110.687 -175.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -87.55 -32.87 19.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.477 -0.328 . . . . 73.329999999999998 111.032 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.7 ptp -81.79 -26.73 34.17 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.497 -0.927 . . . . 52.130000000000003 108.497 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.557 ' HE3' ' HB3' ' B' ' 277' ' ' LEU . 71.6 mtp -83.3 -9.85 58.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.054 -0.975 . . . . 64.219999999999999 110.508 175.048 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 30.1 t70 -66.53 -18.13 65.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.996 -0.547 . . . . 73.120000000000005 111.153 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.501 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 26.6 p90 -124.63 -0.69 8.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.048 -0.524 . . . . 73.409999999999997 110.637 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.586 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 1.5 m-30 -66.79 -56.85 8.61 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 121.352 -0.139 . . . . 54.229999999999997 111.045 -178.17 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.877 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -46.55 -54.26 9.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.122 0.487 . . . . 74.230000000000004 110.363 174.812 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -81.6 17.42 1.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.803 -0.635 . . . . 63.509999999999998 111.771 -174.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.586 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -85.09 -50.2 7.63 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.028 0.442 . . . . 71.209999999999994 110.416 -177.485 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.602 ' HB3' ' HB3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -89.86 10.55 23.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.428 0.633 . . . . 64.140000000000001 109.646 -174.697 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 82.2 tttt -60.96 -49.73 76.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.069 -0.969 . . . . 65.209999999999994 110.735 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -58.95 -41.98 88.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 70.549999999999997 110.906 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 54.0 mtt -64.28 -36.45 84.13 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.653 -0.703 . . . . 73.109999999999999 110.354 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 2.3 tt -74.55 -44.88 48.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.326 -0.852 . . . . 73.420000000000002 110.353 -176.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -60.64 -38.74 85.8 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.327 0.584 . . . . 72.140000000000001 110.313 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.16 -24.64 66.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.196 -0.911 . . . . 74.239999999999995 111.668 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -99.4 -20.68 16.35 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.74 -0.384 . . . . 72.219999999999999 110.429 -178.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.746 ' HE2' ' HA ' ' B' ' 245' ' ' ALA . 16.5 mmt -61.67 -63.85 1.13 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.079 -0.51 . . . . 75.200000000000003 110.503 174.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.606 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 35.7 mt-10 -71.53 -7.34 47.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.074 -0.512 . . . . 75.239999999999995 111.479 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.89 -46.24 75.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.711 -0.477 . . . . 72.019999999999996 109.711 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -73.3 -35.64 66.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.05 -0.523 . . . . 73.120000000000005 110.268 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.606 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 86.5 mt -61.49 -54.27 37.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.853 -0.612 . . . . 54.420000000000002 111.655 -178.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.2 pt-20 -63.9 -19.56 65.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.822 0.344 . . . . 64.319999999999993 111.355 -177.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -104.95 6.87 33.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.466 -0.333 . . . . 74.239999999999995 111.093 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 84.3 t80 -60.97 -38.75 87.06 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.468 -0.567 . . . . 64.549999999999997 109.468 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.325 -0.852 . . . . 52.520000000000003 109.347 175.584 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.716 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 109.624 -0.51 . . . . 74.510000000000005 109.624 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 204' ' ' GLU . . . . . 0.938 ' HG2' ' HE2' ' B' ' 208' ' ' TYR . 1.6 pm0 -60.52 -88.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.139 0.422 . . . . 72.430000000000007 112.139 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -112.26 -40.37 4.18 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.437 -0.505 . . . . 75.319999999999993 110.957 -178.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -81.69 156.66 24.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.176 -0.465 . . . . 70.319999999999993 111.147 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.45 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -76.92 53.4 0.93 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.228 -0.896 . . . . 74.230000000000004 112.259 -178.949 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.938 ' HE2' ' HG2' ' B' ' 204' ' ' GLU . 63.3 m-85 -55.45 -44.25 76.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.71 0.291 . . . . 73.040000000000006 111.314 -178.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.54 -20.46 64.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.073 -0.512 . . . . 34.130000000000003 111.925 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -91.44 -62.58 1.4 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.104 -0.239 . . . . 71.239999999999995 110.686 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.746 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -53.74 -24.06 13.77 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.802 0.667 . . . . 51.329999999999998 112.802 -176.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 11.8 t -65.0 -28.09 69.27 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.672 0.272 . . . . 64.109999999999999 111.161 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.526 ' HB2' HD11 ' A' ' 17' ' ' LEU . 48.3 mt-10 -82.32 -25.23 34.1 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.331 0.586 . . . . 71.340000000000003 109.897 -176.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.746 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.3 mm? -67.04 -44.65 79.69 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.282 -0.872 . . . . 72.030000000000001 108.985 178.149 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.454 HG13 ' HB1' ' A' ' 39' ' ' ALA . 78.1 mt -73.07 -30.45 31.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.494 -0.775 . . . . 61.240000000000002 110.407 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.433 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 39.4 tptt -53.58 -45.53 70.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.765 -0.652 . . . . 75.409999999999997 111.344 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.2 tm? -64.31 -40.01 95.06 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.757 -0.461 . . . . 75.340000000000003 109.757 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -62.13 -27.01 68.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 75.439999999999998 110.973 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 94.7 m-20 -66.58 -31.68 72.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 53.439999999999998 110.65 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 220' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -74.09 -32.24 63.15 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.746 0.308 . . . . 71.439999999999998 111.338 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -82.18 -15.82 51.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.148 0.499 . . . . 72.140000000000001 110.546 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -78.73 -16.08 57.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.839 -0.619 . . . . 65.109999999999999 109.712 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 59.6 mm-40 -85.5 -10.55 55.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.643 -0.708 . . . . 73.109999999999999 109.813 177.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.594 ' OD1' ' HG2' ' B' ' 226' ' ' GLU . 1.2 t-20 -71.55 114.53 9.73 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.147 -0.933 . . . . 70.209999999999994 110.141 -175.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -58.96 -31.61 68.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.47 -0.786 . . . . 72.409999999999997 112.998 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 226' ' ' GLU . . . . . 0.594 ' HG2' ' OD1' ' B' ' 224' ' ' ASN . 12.0 pt-20 -82.69 -7.64 59.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.738 0.304 . . . . 70.430000000000007 111.383 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.582 ' CG2' ' HB2' ' B' ' 231' ' ' GLU . 4.5 mt -113.15 149.12 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.010000000000005 110.419 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -102.68 164.2 11.78 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.534 -0.543 . . . . 65.120000000000005 109.534 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 2.3 m -54.62 -38.51 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.965 0.412 . . . . 54.210000000000001 111.387 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -77.63 -8.74 87.16 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.121 -0.562 . . . . 64.099999999999994 113.663 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.582 ' HB2' ' CG2' ' B' ' 227' ' ' ILE . 5.8 mm-40 -88.72 -33.32 17.56 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.564 0.682 . . . . 72.010000000000005 109.539 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.2 t -71.81 -38.81 66.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.400000000000006 110.272 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 21.4 p -63.5 -43.05 98.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 61.340000000000003 110.4 178.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -70.99 -26.6 63.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.582 . . . . 41.530000000000001 110.866 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.429 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.5 t -66.55 -33.69 76.24 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.562 0.696 . . . . 75.140000000000001 109.158 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.609 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 5.7 t80 -73.38 -28.55 62.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.111 -0.949 . . . . 74.140000000000001 109.842 177.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.602 ' HB3' ' HB3' ' A' ' 73' ' ' TYR . 51.7 mtp -75.64 -46.19 32.96 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.368 -0.378 . . . . 70.349999999999994 110.611 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.409 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 27.2 t-105 -60.85 -40.35 92.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.089 0.471 . . . . 63.240000000000002 110.166 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.427 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.54 -45.56 92.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.609 -0.723 . . . . 54.549999999999997 110.81 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.658 HD21 ' HG2' ' A' ' 37' ' ' MET . 52.1 tp -67.82 -38.41 83.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.895 0.379 . . . . 64.209999999999994 110.511 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.565 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -56.87 -49.58 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.794 -0.639 . . . . 63.310000000000002 111.472 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -86.78 6.37 31.85 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.072 -0.651 . . . . 72.319999999999993 110.887 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -99.63 -36.66 9.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.838 -0.801 . . . . 71.129999999999995 108.838 172.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.35 -39.02 85.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.822 -0.626 . . . . 53.219999999999999 109.575 173.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.746 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -67.21 -16.55 64.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.614 -0.721 . . . . 72.409999999999997 111.732 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -58.86 -34.97 72.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 72.340000000000003 110.858 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -76.53 -2.94 34.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 71.230000000000004 111.777 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -67.27 -30.08 75.07 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.55 -0.833 . . . . 61.200000000000003 111.26 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.0 p -63.89 -22.18 66.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.954 0.407 . . . . 73.140000000000001 111.262 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.9 t -111.91 18.27 18.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.325 -0.398 . . . . 73.519999999999996 110.73 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 9.7 t -81.32 -39.79 24.61 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.771 -0.455 . . . . 71.5 109.771 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.863 ' HE2' ' HE3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -149.17 -174.63 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 74.010000000000005 111.213 179.153 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.472 ' HG3' ' N ' ' B' ' 254' ' ' THR . 12.9 pt-20 -90.34 -50.84 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.774 -0.648 . . . . 65.239999999999995 112.061 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.472 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 80.6 p -107.56 164.06 12.54 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 110.444 -0.206 . . . . 74.129999999999995 110.444 -176.393 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.556 ' HB2' HG23 ' A' ' 85' ' ' ILE . 22.6 ptmt -65.61 -33.48 76.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.766 0.317 . . . . 60.43 110.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.18 -45.8 83.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.99 -0.55 . . . . 73.230000000000004 111.072 -177.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 257' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -87.66 -7.11 57.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.134 -0.485 . . . . 64.530000000000001 111.21 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 9.9 ttt -93.29 -41.5 9.83 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.318 0.58 . . . . 75.209999999999994 109.959 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.536 ' HA ' HD13 ' A' ' 85' ' ' ILE . 44.4 tt0 -56.27 -42.48 77.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.199 -0.909 . . . . 74.439999999999998 111.171 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.29 -5.73 24.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.459 -0.791 . . . . 51.030000000000001 111.83 -176.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.863 ' HE3' ' HE2' ' B' ' 252' ' ' PHE . 0.1 OUTLIER -109.93 5.24 22.24 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.434 -0.348 . . . . 62.539999999999999 110.65 -175.696 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.594 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 13.5 ptpt -51.04 -47.59 61.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 64.209999999999994 111.399 -178.01 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.594 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 4.7 tp-100 -78.89 -11.97 60.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.566 -0.288 . . . . 73.230000000000004 111.05 -173.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.89 -43.23 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.669 -0.241 . . . . 71.109999999999999 111.294 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' B' ' 265' ' ' MET . 2.7 ptt? -76.81 -30.03 56.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.77 -0.772 . . . . 75.209999999999994 109.382 176.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.54 ' HG2' HD22 ' A' ' 77' ' ' LEU . 62.4 mtp -88.39 16.39 6.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.805 -0.634 . . . . 72.099999999999994 110.41 177.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 267' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 20.7 t70 -90.01 -36.49 14.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.136 0.493 . . . . 64.329999999999998 109.696 175.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.409 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 39.8 p90 -107.72 -14.53 14.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.983 -0.553 . . . . 72.329999999999998 111.544 -174.288 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -57.17 -60.72 3.18 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 121.018 -0.273 . . . . 73.219999999999999 110.533 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.877 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.07 -45.39 52.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.645 0.736 . . . . 62.020000000000003 110.181 175.935 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -84.26 9.01 14.04 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.088 -0.96 . . . . 74.040000000000006 112.052 -170.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 2.9 mtm180 -88.39 -41.4 12.84 Favored 'General case' 0 CA--C 1.513 -0.453 0 O-C-N 121.834 -0.541 . . . . 73.209999999999994 110.648 -176.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.581 ' HB3' ' HB3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -94.79 7.48 45.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.509 0.671 . . . . 73.310000000000002 109.268 -175.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 79.5 tttt -61.54 -57.16 13.2 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.688 -1.142 . . . . 73.329999999999998 111.14 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.4 -32.6 74.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.703 0.287 . . . . 74.329999999999998 110.882 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 63.8 mtt -60.93 -41.12 95.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.481 0.658 . . . . 53.329999999999998 109.509 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.557 ' HB3' ' HE3' ' A' ' 66' ' ' MET . 0.9 OUTLIER -69.49 -41.87 75.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.147 -0.933 . . . . 65.019999999999996 109.73 179.08 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.76 -41.45 86.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.543 -0.753 . . . . 72.200000000000003 110.611 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.9 -20.87 59.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.255 -0.884 . . . . 75.319999999999993 112.034 -177.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -92.25 -24.68 18.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.676 -0.41 . . . . 72.120000000000005 110.556 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.579 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 18.3 mmt -58.98 -59.3 5.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.916 -0.584 . . . . 72.219999999999999 110.69 174.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.591 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.9 mt-10 -63.57 -20.99 66.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.595 -0.73 . . . . 72.430000000000007 112.336 -174.271 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.92 -48.72 77.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.176 0.512 . . . . 71.299999999999997 110.139 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -77.07 -25.32 52.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.005 -0.543 . . . . 74.109999999999999 110.445 178.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.666 HD13 ' HA ' ' A' ' 59' ' ' GLN . 63.4 mt -71.03 -56.31 11.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.095 -0.502 . . . . 62.009999999999998 111.279 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -64.4 -28.21 69.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.739 0.304 . . . . 74.530000000000001 111.64 -176.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -91.71 3.21 55.63 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.99 -0.284 . . . . 72.25 111.087 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.624 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 80.4 t80 -59.14 -39.78 83.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.85 -0.159 . . . . 74.349999999999994 110.935 -179.388 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 . . . . . 0 C--N 1.326 -0.42 0 CA-C-O 121.079 0.466 . . . . 71.010000000000005 110.212 178.26 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.5 p-10 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.844 0.354 . . . . 74.209999999999994 110.178 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.432 ' HB3' ' H ' ' A' ' 5' ' ' ASN . 9.4 tp10 -79.5 -86.37 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.416 -0.587 . . . . 75.349999999999994 109.416 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.432 ' H ' ' HB3' ' A' ' 4' ' ' GLU . 23.6 t30 -113.09 -42.71 3.49 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.765 -0.828 . . . . 71.420000000000002 108.765 170.32 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -71.81 154.12 41.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.271 -0.877 . . . . 71.109999999999999 111.972 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.487 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -77.77 57.07 1.6 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.239 -1.346 . . . . 74.310000000000002 111.954 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.436 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 67.3 m-85 -54.75 -40.91 69.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.315 -0.402 . . . . 63.439999999999998 111.802 -178.244 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.74 -16.18 61.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 65.019999999999996 111.655 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -87.33 -60.91 1.84 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.532 -0.304 . . . . 73.109999999999999 110.389 176.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.795 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -61.53 -16.74 50.5 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.887 0.699 . . . . 53.130000000000003 112.887 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.552 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 14.7 t -65.05 -30.44 71.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.035 -0.266 . . . . 53.32 111.016 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.541 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.2 mt-10 -81.6 -26.36 34.96 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.167 0.508 . . . . 74.430000000000007 110.151 -176.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.795 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.6 mm? -63.6 -41.67 98.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.543 -0.753 . . . . 73.430000000000007 109.804 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.497 HG23 ' HD2' ' B' ' 243' ' ' TYR . 69.1 mt -72.71 -22.74 20.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.609 -0.723 . . . . 70.019999999999996 110.688 178.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 12' ' ' THR . 30.7 mmmt -64.42 -34.57 78.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.564 -0.289 . . . . 74.109999999999999 111.024 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -63.13 -37.27 86.55 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.009 -0.737 . . . . 75.510000000000005 109.009 177.402 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.47 71.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.657 -0.701 . . . . 74.049999999999997 110.491 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.52 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 12.1 m-80 -59.96 -43.53 95.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.762 -0.654 . . . . 63.509999999999998 110.553 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -65.46 -35.23 80.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.769 -0.651 . . . . 73.239999999999995 111.436 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.37 -27.21 41.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 72.409999999999997 110.633 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -79.88 -0.91 36.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.316 0.579 . . . . 73.409999999999997 110.288 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 94.4 mt-30 -75.16 -8.85 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.034 -0.53 . . . . 72.319999999999993 109.982 174.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -78.93 156.14 28.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.323 -0.853 . . . . 75.540000000000006 110.1 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.2 t -128.46 -14.78 4.66 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.131 0.491 . . . . 61.119999999999997 109.922 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -83.94 -2.73 57.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.563 -0.744 . . . . 64.319999999999993 110.303 174.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.2 mt -122.86 149.28 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 108.829 -0.804 . . . . 55.130000000000003 108.829 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.722 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -77.8 150.68 34.25 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.813 0.339 . . . . 64.530000000000001 110.391 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -61.3 -31.4 71.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.288 0.566 . . . . 72.109999999999999 109.771 174.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.712 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -68.08 -22.14 74.07 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.495 -0.775 . . . . 65.120000000000005 113.296 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.722 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 11.3 mm-40 -74.24 -34.25 63.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.334 0.588 . . . . 73.420000000000002 109.69 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.5 t -69.43 -44.61 79.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.592 -0.731 . . . . 73.120000000000005 110.534 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.421 ' HB3' ' CE1' ' B' ' 243' ' ' TYR . 15.1 p -65.29 -39.43 92.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.096 -0.502 . . . . 71.340000000000003 110.709 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.95 -35.01 79.79 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.847 -0.615 . . . . 64.329999999999998 110.383 177.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.538 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 52.5 m -63.83 -40.26 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.847 0.356 . . . . 73.409999999999997 110.096 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.703 ' HD1' HD12 ' B' ' 214' ' ' LEU . 10.4 t80 -62.06 -40.53 96.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.362 0.601 . . . . 64.310000000000002 109.737 177.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.676 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.4 ttm -67.14 -45.44 77.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.582 -0.736 . . . . 72.219999999999999 111.612 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.604 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 18.8 t-105 -64.61 -35.79 82.16 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.986 0.422 . . . . 72.030000000000001 110.568 177.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.447 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.74 -39.39 93.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.134 -0.485 . . . . 61.020000000000003 110.657 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 56.4 tp -65.62 -35.6 81.3 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.466 -0.334 . . . . 71.239999999999995 110.161 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.3 -44.13 95.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 71.519999999999996 110.809 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.23 -35.68 66.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.175 -0.466 . . . . 62.310000000000002 110.627 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.406 ' HE1' ' OG ' ' B' ' 233' ' ' SER . 9.9 t80 -73.7 -33.51 64.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 63.420000000000002 110.786 -177.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 6.8 t-20 -76.09 -35.71 59.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.083 0.468 . . . . 41.299999999999997 110.767 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.73 -15.1 63.3 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.913 -0.585 . . . . 74.450000000000003 111.311 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -59.29 -35.82 74.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.714 -0.676 . . . . 74.540000000000006 111.428 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.526 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.3 m-85 -71.44 -9.08 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.402 -0.363 . . . . 62.200000000000003 111.888 -176.535 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -29.56 64.31 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.349 -0.929 . . . . 62.25 111.294 175.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.526 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 50.2 p -61.44 -32.77 72.75 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.709 0.29 . . . . 53.530000000000001 111.652 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -103.1 16.86 25.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.185 0.517 . . . . 71.200000000000003 110.695 -176.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.29 -47.34 24.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.167 -0.469 . . . . 72.150000000000006 110.72 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.457 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.9 OUTLIER -142.68 -175.11 4.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.32 0.581 . . . . 71.25 112.297 -176.929 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -99.09 -28.06 13.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.916 -1.038 . . . . 61.119999999999997 111.679 -173.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.2 p -127.56 160.01 32.88 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.14 -0.482 . . . . 55.539999999999999 110.302 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.592 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 19.5 ptmt -68.92 -38.01 79.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.548 -0.296 . . . . 75.349999999999994 111.19 -177.132 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -30.2 71.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.502 -0.317 . . . . 74.420000000000002 111.415 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -92.29 -29.12 16.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.031 0.443 . . . . 63.009999999999998 110.557 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.526 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 17.8 ttt -69.73 -43.8 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.724 -0.671 . . . . 73.340000000000003 110.778 178.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.625 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.1 tt0 -62.62 -33.47 75.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.699 -0.682 . . . . 71.140000000000001 111.639 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.02 -23.75 64.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.095 0.474 . . . . 74.310000000000002 111.133 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.3 mmmt -89.32 -0.36 57.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.917 -0.583 . . . . 63.240000000000002 110.777 -174.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.588 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 10.0 ptpp? -51.75 -47.16 64.2 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 123.597 0.561 . . . . 73.040000000000006 110.491 -175.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.588 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 5.4 tp-100 -86.15 -21.92 27.3 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.085 -0.507 . . . . 65.540000000000006 110.214 -175.182 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.4 ' OE2' ' HD2' ' A' ' 61' ' ' LYS . 48.8 mt-10 -73.41 -40.54 64.19 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.601 -0.727 . . . . 63.149999999999999 110.837 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.4 ptp -79.26 -27.58 42.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.257 0.551 . . . . 63.329999999999998 109.584 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 62' ' ' LYS . 90.2 mtp -78.71 -17.33 56.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.813 -0.63 . . . . 65.400000000000006 110.915 177.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -60.63 -31.27 70.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.196 0.522 . . . . 35.43 111.345 -172.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -108.65 -10.43 15.2 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.598 -0.441 . . . . 72.140000000000001 111.005 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.531 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 5.4 m-30 -58.7 -53.94 52.74 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.623 0.249 . . . . 75.5 111.088 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.696 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -50.97 -53.63 31.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.254 0.55 . . . . 75.239999999999995 110.725 175.825 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.569 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 4.2 t70 -89.5 32.53 0.86 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.394 -0.821 . . . . 74.319999999999993 110.817 -172.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.659 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 2.1 mmm180 -94.01 -37.26 11.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.254 -0.43 . . . . 71.239999999999995 111.221 -177.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.718 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -100.19 10.77 40.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.479 -0.328 . . . . 71.310000000000002 110.464 -178.949 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.8 tttp -59.28 -59.72 5.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.589 . . . . 73.519999999999996 110.578 -176.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -63.35 -29.44 70.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.735 -0.666 . . . . 75.299999999999997 111.561 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.538 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 39.9 mtm -79.49 -27.77 41.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.226 0.536 . . . . 64.230000000000004 109.935 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.772 HD21 ' HD2' ' B' ' 269' ' ' TYR . 65.1 tp -70.11 -43.77 70.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.48 -0.782 . . . . 71.400000000000006 109.676 176.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.02 -34.09 71.49 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.278 -0.874 . . . . 72.010000000000005 110.506 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.17 -12.49 60.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.41 -0.814 . . . . 54.25 112.125 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.436 ' OD1' ' HG2' ' B' ' 242' ' ' ARG . 31.4 m-80 -100.92 -20.41 15.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.988 0.423 . . . . 63.149999999999999 111.322 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.417 ' C ' ' H ' ' A' ' 83' ' ' ASP . 63.0 mtt -78.84 -168.07 1.32 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.363 -0.38 . . . . 74.540000000000006 110.019 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 6.4 mm-40 68.46 -32.31 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 113.741 1.015 . . . . 74.400000000000006 113.741 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.417 ' H ' ' C ' ' A' ' 81' ' ' MET . 27.8 t70 -53.25 -58.3 7.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.88 0.326 . . . . 55.119999999999997 111.88 -177.462 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -88.53 -3.52 58.79 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.875 -0.73 . . . . 74.439999999999998 111.121 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.573 HG21 ' HB2' ' B' ' 259' ' ' GLN . 48.6 mt -74.78 -56.91 7.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.082 0.468 . . . . 72.319999999999993 109.84 173.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 10.0 pt-20 -60.86 -38.71 86.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 62.039999999999999 110.672 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -87.93 8.93 23.96 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.293 -0.412 . . . . 61.420000000000002 111.651 -177.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.442 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 72.8 t80 -57.72 -42.32 83.58 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.158 -0.312 . . . . 70.230000000000004 110.158 178.513 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 . . . . . 0 CA--C 1.519 -0.231 0 CA-C-O 121.156 0.503 . . . . 72.409999999999997 110.019 177.469 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.67 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.1 p-10 . . . . . 0 N--CA 1.454 -0.248 0 N-CA-C 109.653 -0.499 . . . . 75.319999999999993 109.653 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -76.11 -83.43 0.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.11 -0.7 . . . . 74.230000000000004 109.11 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -119.57 -30.81 4.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.103 -0.702 . . . . 51.439999999999998 109.103 170.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.67 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -88.47 157.18 18.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.688 -0.687 . . . . 64.450000000000003 111.811 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.538 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -86.15 49.57 1.81 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.627 -1.17 . . . . 74.420000000000002 111.954 -175.571 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -45.13 -50.22 11.35 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.438 0.533 . . . . 72.340000000000003 112.438 -176.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 209' ' ' ALA . . . . . 0.517 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -59.88 -44.09 94.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 75.340000000000003 112.229 -174.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 32.3 mmt180 -67.28 -49.99 62.1 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.148 0.425 . . . . 64.200000000000003 112.148 -175.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.631 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -63.3 -18.71 63.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.691 0.758 . . . . 72.310000000000002 110.62 -177.458 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 212' ' ' THR . . . . . 0.517 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 49.3 m -68.64 -28.12 66.61 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.006 -0.997 . . . . 54.310000000000002 111.014 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.408 ' HB2' HD11 ' A' ' 17' ' ' LEU . 28.4 mt-10 -80.06 -29.32 39.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.462 0.649 . . . . 74.030000000000001 109.509 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.703 HD12 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -63.94 -45.43 89.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.214 -0.903 . . . . 75.430000000000007 109.922 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.447 HG13 ' HB1' ' A' ' 39' ' ' ALA . 77.3 mt -66.8 -24.82 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 54.409999999999997 110.302 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -30.57 70.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 74.349999999999994 110.661 -176.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.631 HD12 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -70.37 -40.75 73.81 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.783 -0.821 . . . . 70.109999999999999 108.783 175.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.58 -29.88 70.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.474 -0.784 . . . . 75.450000000000003 110.183 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.519 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 2.7 t-20 -59.9 -38.34 81.99 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.33 -0.85 . . . . 71.239999999999995 110.405 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -69.41 -39.71 77.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.763 -0.653 . . . . 63.210000000000001 111.282 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -74.0 -25.24 59.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.159 0.504 . . . . 75.540000000000006 110.163 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -84.07 -3.64 58.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.837 -0.62 . . . . 63.399999999999999 110.751 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 25.5 mt-30 -71.03 -10.73 60.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.436 0.636 . . . . 70.010000000000005 109.94 173.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -83.42 128.55 34.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.05 -0.977 . . . . 72.310000000000002 109.723 177.057 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -98.46 -21.82 16.36 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.079 0.466 . . . . 61.229999999999997 110.817 -175.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -76.9 -17.93 58.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.084 0.469 . . . . 70.209999999999994 110.724 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 7.3 mt -98.95 153.49 4.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.518 -0.919 . . . . 72.129999999999995 108.518 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.579 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 1.3 mp0 -80.57 146.38 31.28 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.454 -0.572 . . . . 73.030000000000001 109.454 176.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 27.6 m -58.25 -33.12 69.02 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.221 -0.659 . . . . 63.100000000000001 109.221 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 230' ' ' GLY . . . . . 0.526 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -61.71 -29.71 72.84 Favored Glycine 0 C--N 1.334 0.44 0 CA-C-N 115.084 -0.962 . . . . 24.420000000000002 113.149 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.579 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 11.4 mm-40 -66.2 -36.43 83.05 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 117.356 0.578 . . . . 63.329999999999998 109.657 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.1 t -77.78 -27.75 15.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.371 -0.831 . . . . 65.219999999999999 110.108 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 233' ' ' SER . . . . . 0.462 ' HG ' ' HE2' ' A' ' 47' ' ' PHE . 1.8 m -70.83 -40.92 72.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.797 -0.638 . . . . 55.340000000000003 109.46 176.187 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -71.44 -34.34 70.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.264 -0.88 . . . . 71.109999999999999 111.223 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.477 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 30.1 p -67.89 -36.41 80.18 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.949 0.404 . . . . 63.130000000000003 110.016 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.58 ' CD1' HD12 ' A' ' 14' ' ' LEU . 6.6 t80 -62.45 -42.04 99.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.522 0.677 . . . . 73.430000000000007 109.421 174.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.718 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 8.6 ttm -66.09 -45.83 79.82 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.518 -0.764 . . . . 74.140000000000001 111.733 179.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.538 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 33.9 t-105 -63.7 -35.45 80.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 72.420000000000002 110.716 177.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -66.17 -35.48 80.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.499 -0.319 . . . . 75.340000000000003 110.789 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 52.4 tp -68.04 -35.87 78.97 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.285 -0.635 . . . . 75.239999999999995 109.285 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.441 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -66.15 -16.84 64.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.788 -0.642 . . . . 74.319999999999993 111.185 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 242' ' ' ARG . . . . . 0.436 ' HG2' ' OD1' ' A' ' 80' ' ' ASN . 36.8 mtm180 -95.47 -47.77 6.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.993 0.425 . . . . 64.319999999999993 110.411 176.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.497 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.6 t80 -70.99 -34.57 71.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.827 -0.624 . . . . 70.510000000000005 111.221 -173.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -81.33 -20.28 41.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.056 0.455 . . . . 62.340000000000003 111.229 -175.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -78.8 -7.46 57.87 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.469 . . . . 74.129999999999995 110.746 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -65.45 -27.64 68.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.487 -0.779 . . . . 73.450000000000003 110.908 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.712 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 74.2 m-85 -75.09 -0.52 19.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.08 -0.509 . . . . 72.120000000000005 112.037 -175.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -63.2 -27.59 70.83 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.096 -1.05 . . . . 72.219999999999999 110.694 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 75.7 p -70.16 -8.63 51.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.456 -0.372 . . . . 72.340000000000003 111.672 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 10.8 t -120.87 8.29 10.5 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.967 -0.293 . . . . 53.030000000000001 110.873 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 68.6 m -78.0 -44.3 27.03 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-O 120.63 0.252 . . . . 65.319999999999993 110.641 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.486 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 2.4 m-85 -149.07 177.57 9.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.867 0.365 . . . . 74.219999999999999 111.231 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.403 ' HG3' HG23 ' B' ' 254' ' ' THR . 8.9 pt-20 -91.5 -34.83 14.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.588 -0.733 . . . . 70.239999999999995 111.897 -172.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.403 HG23 ' HG3' ' B' ' 253' ' ' GLU . 75.4 p -117.98 161.4 19.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.411 -0.359 . . . . 70.439999999999998 110.508 -179.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.442 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.5 ptmt -66.55 -35.05 79.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.488 -0.324 . . . . 61.109999999999999 110.954 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.09 -50.03 73.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.061 0.458 . . . . 74.049999999999997 110.788 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.662 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 95.1 mt-30 -75.51 -23.62 56.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 75.140000000000001 110.392 -177.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.3 ttt -77.32 -47.52 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 74.049999999999997 110.665 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.573 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.6 tt0 -63.65 -35.07 79.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.693 -0.685 . . . . 63.130000000000003 111.689 -176.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.46 -13.31 62.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.844 0.354 . . . . 70.349999999999994 110.975 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.662 ' HD3' ' O ' ' B' ' 257' ' ' GLN . 3.2 mptp? -106.51 9.95 31.42 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.956 -0.566 . . . . 72.049999999999997 111.134 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.551 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.0 ptpt -50.37 -46.33 55.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 73.420000000000002 110.259 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.551 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.2 tp60 -80.54 -29.74 37.15 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.054 -0.521 . . . . 74.299999999999997 110.057 -177.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -67.26 -39.09 86.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 71.019999999999996 111.413 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -83.72 -24.29 31.27 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.563 -0.532 . . . . 70.049999999999997 109.563 -177.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 266' ' ' MET . . . . . . . . . . . . . 75.4 mtp -85.03 -22.37 29.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 73.430000000000007 111.599 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 267' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 17.0 t70 -62.21 -42.64 99.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.992 0.425 . . . . 72.409999999999997 111.025 -170.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.624 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 27.3 p90 -90.35 -14.42 33.12 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.907 -0.588 . . . . 72.019999999999996 110.647 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.772 ' HD2' HD21 ' A' ' 77' ' ' LEU . 1.3 m-30 -57.54 -47.12 82.89 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.606 0.241 . . . . 75.209999999999994 111.052 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.569 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -56.2 -48.13 77.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.195 0.521 . . . . 75.340000000000003 110.422 174.689 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -84.4 20.8 1.58 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.491 -0.777 . . . . 65.340000000000003 111.65 -171.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 14.6 mmm180 -90.38 -51.09 5.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 71.109999999999999 110.813 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.696 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -92.65 8.83 37.43 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.069 -0.514 . . . . 75.019999999999996 110.538 -177.185 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.485 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 87.8 tttt -59.59 -59.48 5.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.919 -0.582 . . . . 73.400000000000006 110.916 -177.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.33 -33.98 77.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.23 -0.441 . . . . 63.229999999999997 111.187 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 276' ' ' MET . . . . . 0.604 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 41.0 mtm -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.108 0.48 . . . . 74.400000000000006 110.441 -178.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 5.5 tt -70.96 -43.42 68.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.998 -0.742 . . . . 74.040000000000006 108.998 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -56.38 -37.13 69.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.961 -1.018 . . . . 70.340000000000003 111.12 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -68.47 -14.98 63.38 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.447 -0.797 . . . . 75.040000000000006 112.36 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -96.6 -13.33 22.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.878 0.371 . . . . 64.319999999999993 111.487 -178.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 62.9 mtt -85.56 179.58 7.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.777 0.323 . . . . 72.120000000000005 111.122 176.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.559 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 20.6 mt-10 69.89 -24.06 0.15 Allowed 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.416 1.086 . . . . 64.019999999999996 113.381 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -50.25 -60.18 3.23 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.896 0.379 . . . . 73.430000000000007 111.699 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -85.13 5.66 28.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 62.229999999999997 111.221 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.625 HG21 ' HB2' ' A' ' 59' ' ' GLN . 50.3 mt -92.82 -54.73 6.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.876 0.37 . . . . 74.319999999999993 110.507 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.8 pt-20 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.053 -0.521 . . . . 54.130000000000003 110.337 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.38 2.28 52.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 75.010000000000005 111.359 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.592 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 71.0 t80 -55.99 -48.19 76.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.634 0.254 . . . . 74.230000000000004 110.915 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.712 -178.462 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 108.944 -0.761 . . . . 63.200000000000003 108.944 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.98 -79.69 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.123 0.487 . . . . 64.510000000000005 110.759 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -125.71 -35.85 2.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.947 -0.569 . . . . 62.240000000000002 110.393 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . . . -80.81 159.82 25.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.091 -0.504 . . . . 74.349999999999994 111.005 179.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.567 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -82.06 49.17 1.34 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.293 -0.867 . . . . 71.400000000000006 111.995 -176.413 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 6' ' ' ALA . 58.1 m-85 -51.93 -42.21 62.63 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.046 0.451 . . . . 74.209999999999994 111.235 -178.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.11 -13.64 61.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.742 -0.663 . . . . 74.209999999999994 112.509 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 10' ' ' ARG . 20.5 mtm180 -94.71 -57.23 2.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.542 -0.463 . . . . 72.239999999999995 110.262 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.768 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -57.49 -22.47 44.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 55.009999999999998 112.54 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -62.75 -26.92 68.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.745 0.307 . . . . 71.439999999999998 110.955 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.487 ' HB2' HD11 ' B' ' 217' ' ' LEU . 30.0 mt-10 -83.12 -29.56 28.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.169 0.509 . . . . 73.019999999999996 109.772 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.768 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -62.82 -48.58 78.48 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.244 -0.889 . . . . 74.540000000000006 109.42 177.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.512 HG23 ' HD2' ' B' ' 243' ' ' TYR . 78.5 mt -64.07 -33.63 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.661 . . . . 73.140000000000001 110.281 176.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.414 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.6 tmmt? -60.11 -35.13 74.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.608 -0.724 . . . . 75.5 111.48 -176.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.463 HD12 HD13 ' B' ' 214' ' ' LEU . 2.6 tm? -63.54 -45.97 88.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.392 -0.596 . . . . 51.409999999999997 109.392 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.59 68.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.723 -0.671 . . . . 61.219999999999999 111.225 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.45 -26.33 68.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 62.109999999999999 111.214 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.434 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 1.4 mp0 -81.07 -14.97 57.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.838 0.351 . . . . 75.349999999999994 111.057 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -101.44 -35.28 9.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.95 0.405 . . . . 71.230000000000004 110.764 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.649 ' HA ' HG21 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -78.0 -8.95 58.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.208 -0.451 . . . . 73.310000000000002 110.721 -175.98 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 15.9 pt20 -80.87 9.0 7.0 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.839 -0.344 . . . . 74.209999999999994 111.531 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -82.84 103.46 12.34 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.231 -1.026 . . . . 74.510000000000005 108.231 173.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -60.16 -31.68 70.33 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 113.146 0.795 . . . . 74.010000000000005 113.146 -169.249 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -80.68 -13.43 59.03 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.227 0.455 . . . . 74.129999999999995 112.227 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 9.2 mt -98.66 147.8 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.448 -0.575 . . . . 50.009999999999998 109.448 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -89.42 159.75 17.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.824 0.345 . . . . 73.230000000000004 110.301 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.3 m -56.88 -33.33 66.77 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.529 -0.759 . . . . 75.510000000000005 111.315 -176.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -58.27 -32.4 67.75 Favored Glycine 0 C--N 1.332 0.34 0 CA-C-N 115.62 -0.718 . . . . 54.310000000000002 113.871 -176.593 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -69.27 -31.79 70.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.27 0.535 . . . . 74.310000000000002 110.932 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.649 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.3 t -88.63 -40.82 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.855 -0.611 . . . . 70.450000000000003 110.967 -176.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.8 p -61.59 -41.78 97.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.953 0.406 . . . . 72.329999999999998 110.635 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.3 73.88 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.014 -0.539 . . . . 74.329999999999998 110.958 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.479 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 46.2 m -63.51 -36.21 83.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.886 0.374 . . . . 61.409999999999997 110.068 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.556 ' CD1' HD12 ' B' ' 214' ' ' LEU . 2.5 t80 -69.5 -32.78 71.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.374 0.606 . . . . 73.439999999999998 109.66 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.786 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.2 tpt -67.36 -52.33 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.45 -0.795 . . . . 71.019999999999996 110.945 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.652 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -63.84 -34.89 78.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.937 -0.574 . . . . 75.450000000000003 110.906 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.41 -40.64 97.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.122 -0.49 . . . . 75.510000000000005 111.095 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 53.9 tp -68.37 -35.29 77.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.734 -0.469 . . . . 64.25 109.734 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.88 77.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.400000000000006 111.0 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.448 ' HG2' ' CG ' ' B' ' 280' ' ' ASN . 10.8 mtp180 -77.48 -46.46 22.42 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.019 -0.272 . . . . 74.239999999999995 111.139 177.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.588 ' HD2' HG23 ' B' ' 215' ' ' ILE . 7.5 t80 -66.57 -31.86 72.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 62.409999999999997 110.884 -175.159 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -77.33 -38.3 50.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.038 0.447 . . . . 52.509999999999998 109.95 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.88 -19.61 65.04 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.792 -0.64 . . . . 63.210000000000001 111.171 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.5 t90 -59.39 -33.54 71.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.845 -0.616 . . . . 72.129999999999995 110.029 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -82.66 -5.47 58.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 62.140000000000001 111.131 178.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.524 ' O ' ' HE3' ' A' ' 58' ' ' MET . . . -70.62 -23.87 77.36 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.896 -0.881 . . . . 73.349999999999994 110.896 174.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -61.46 -31.84 71.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.949 0.405 . . . . 52.210000000000001 111.26 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -97.91 13.42 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 71.530000000000001 111.103 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.1 m -77.02 -34.59 57.38 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 111.854 0.316 . . . . 71.340000000000003 111.854 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.725 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -143.33 -172.27 3.66 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.641 -0.424 . . . . 55.520000000000003 111.63 -179.551 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.725 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 16.9 pt-20 -108.31 -30.11 8.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.376 -0.829 . . . . 61.229999999999997 112.025 -170.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.451 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 47.1 p -127.87 155.28 44.4 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 109.715 -0.476 . . . . 65.319999999999993 109.715 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -72.03 -29.57 64.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.84 -0.344 . . . . 74.25 110.77 -177.157 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' OE1' ' HB ' ' A' ' 54' ' ' THR . 2.0 mp0 -60.92 -46.19 91.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.231 0.538 . . . . 74.140000000000001 110.186 177.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 24.6 mt-30 -81.58 -37.57 27.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.667 -0.697 . . . . 74.230000000000004 110.581 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.524 ' HE3' ' O ' ' A' ' 48' ' ' GLY . 16.5 ttt -63.17 -42.73 99.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 63.350000000000001 111.211 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 29.2 tt0 -64.69 -32.18 73.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.277 -0.419 . . . . 65.409999999999997 110.583 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.57 -12.34 60.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.149 0.5 . . . . 62.310000000000002 110.854 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -106.53 11.1 31.0 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.208 -0.451 . . . . 64.310000000000002 109.979 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.608 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 15.4 ptpt -54.27 -49.37 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 71.540000000000006 110.064 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.608 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 4.5 tp-100 -75.15 -26.97 59.55 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.98 -0.555 . . . . 71.430000000000007 110.239 -176.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 61' ' ' LYS . 25.0 mm-40 -58.85 -49.47 77.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.99 -0.55 . . . . 74.230000000000004 111.011 -178.441 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.464 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 3.4 ptt? -82.69 -34.86 27.2 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.067 0.46 . . . . 74.510000000000005 110.631 -177.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.531 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 67.1 mtp -77.08 -21.98 53.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 51.140000000000001 112.097 -174.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 25.6 t70 -58.95 -36.25 74.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 71.239999999999995 111.365 -171.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.492 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 28.2 p90 -107.15 -6.11 17.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 71.519999999999996 111.534 -176.619 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.531 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 3.4 m-30 -58.56 -41.95 86.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.709 0.29 . . . . 73.109999999999999 110.943 -178.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.517 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -53.28 -52.35 59.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 64.519999999999996 110.665 174.992 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -90.48 65.98 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 71.129999999999995 110.958 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 15.3 mmm-85 -130.98 -23.24 2.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.195 -0.457 . . . . 71.140000000000001 111.337 177.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.765 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -116.05 7.74 14.35 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.543 -0.463 . . . . 74.519999999999996 111.755 -178.782 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.3 pttm -76.2 -33.92 59.29 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.856 -0.738 . . . . 74.120000000000005 110.323 -173.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 1.6 pm0 -67.69 -25.17 65.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.278 0.561 . . . . 74.109999999999999 110.604 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.505 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 58.5 mtm -91.16 -18.95 23.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.818 -0.628 . . . . 71.219999999999999 109.971 178.116 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.487 HD13 ' CE ' ' B' ' 270' ' ' MET . 7.0 tt -82.39 -37.39 25.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.73 -0.668 . . . . 55.119999999999997 109.729 176.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.402 ' N ' ' HE1' ' B' ' 266' ' ' MET . 12.8 t70 -57.81 -37.56 73.99 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.256 0.551 . . . . 70.040000000000006 110.142 177.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.1 70.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.265 -0.879 . . . . 64.109999999999999 111.679 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -82.83 -23.09 33.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.016 0.436 . . . . 74.5 110.286 -178.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.484 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.3 mmt -66.54 -50.28 63.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.81 -0.632 . . . . 60.130000000000003 110.123 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 44.7 mt-10 -55.77 -31.82 62.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.681 -0.69 . . . . 73.299999999999997 111.637 -177.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -53.7 -34.74 59.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.855 0.36 . . . . 74.439999999999998 111.04 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.72 -29.14 10.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.286 -0.415 . . . . 74.510000000000005 111.255 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 81' ' ' MET . 58.5 mt -66.77 -64.53 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.653 0.242 . . . . 63.329999999999998 111.653 -178.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.3 pt-20 -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.451 -0.5 . . . . 75.0 110.745 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 24.4 m120 -93.04 15.72 14.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.139 -0.482 . . . . 71.340000000000003 111.004 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.577 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 24.7 t80 -54.46 -49.78 69.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.707 0.289 . . . . 74.010000000000005 110.985 178.535 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 111.004 179.148 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.665 0.269 . . . . 72.349999999999994 110.562 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 204' ' ' GLU . . . . . 0.444 ' H ' ' HE2' ' B' ' 208' ' ' TYR . 26.0 mt-10 -82.76 -94.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 54.109999999999999 111.164 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 205' ' ' ASN . . . . . 0.402 ' H ' ' HB2' ' B' ' 204' ' ' GLU . 12.7 t30 -103.32 -26.66 12.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.879 -0.6 . . . . 61.409999999999997 110.055 -177.357 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -110.0 153.29 24.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.581 -0.736 . . . . 64.439999999999998 110.475 176.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.652 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -79.05 54.89 1.69 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.422 -0.808 . . . . 71.510000000000005 112.464 -177.757 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.444 ' HE2' ' H ' ' B' ' 204' ' ' GLU . 17.6 m-85 -50.95 -40.8 58.4 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.92 0.39 . . . . 75.219999999999999 111.379 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.34 -27.53 66.0 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.479 -0.782 . . . . 71.519999999999996 112.696 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 53.6 mtm-85 -91.88 -55.38 3.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.548 -0.461 . . . . 72.010000000000005 110.651 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.632 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.4 -22.64 44.31 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 34.130000000000003 112.814 -177.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 7.0 t -67.04 -25.81 66.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.95 0.405 . . . . 54.439999999999998 110.51 -177.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -82.45 -29.22 30.79 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.345 0.593 . . . . 71.329999999999998 109.787 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.632 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -64.51 -45.35 87.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.076 -0.965 . . . . 72.5 109.392 177.239 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.588 HG23 ' HD2' ' A' ' 43' ' ' TYR . 82.0 mt -67.35 -33.03 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.564 -0.744 . . . . 71.109999999999999 110.452 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -35.59 73.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.683 -0.69 . . . . 63.43 111.286 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.535 HD12 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -64.57 -45.37 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.414 -0.587 . . . . 75.329999999999998 109.414 178.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.88 -31.84 68.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 74.349999999999994 111.164 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.504 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 5.5 m-20 -61.08 -38.08 84.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 71.120000000000005 110.919 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -67.68 -34.48 76.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.197 -0.456 . . . . 70.299999999999997 111.466 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -79.33 -23.07 43.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.445 0.64 . . . . 73.510000000000005 110.049 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -75.64 -16.25 60.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.266 -0.879 . . . . 74.209999999999994 110.267 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.504 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 35.7 mt-30 -76.63 -4.11 41.29 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 73.219999999999999 111.201 -179.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.419 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.1 t-20 -73.01 107.66 5.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.545 -0.539 . . . . 34.530000000000001 109.545 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.0 t -57.71 -35.71 71.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.017 0.747 . . . . 75.209999999999994 113.017 -171.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -85.32 1.55 47.93 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.508 0.559 . . . . 73.319999999999993 112.508 -177.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.419 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.1 mt -113.76 149.85 16.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.03 0.443 . . . . 61.310000000000002 110.326 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -92.53 160.22 15.14 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.853 -0.612 . . . . 65.219999999999999 109.875 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 6.8 m -63.02 -29.63 70.97 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.19 -0.459 . . . . 75.530000000000001 111.227 -176.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -67.38 -12.22 60.71 Favored Glycine 0 C--N 1.331 0.297 0 CA-C-N 115.901 -0.59 . . . . 73.420000000000002 113.339 -177.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.401 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 67.9 mm-40 -83.47 -25.79 30.84 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.342 -0.505 . . . . 74.409999999999997 110.524 178.027 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.9 t -85.35 -39.16 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.963 -0.562 . . . . 43.310000000000002 110.43 -177.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.2 p -59.06 -41.64 88.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 74.299999999999997 110.957 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.83 -32.1 71.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 74.439999999999998 111.016 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 49.9 m -65.43 -38.02 88.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.82 0.343 . . . . 43.439999999999998 110.279 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.672 ' HD1' HD12 ' A' ' 14' ' ' LEU . 11.9 t80 -66.36 -33.66 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.259 0.552 . . . . 64.219999999999999 109.831 178.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.765 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 9.3 ttm -69.18 -46.0 68.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.507 -0.769 . . . . 72.349999999999994 111.735 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.567 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 19.8 t-105 -64.59 -38.51 91.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.85 0.357 . . . . 74.010000000000005 110.645 177.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.5 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -61.82 -40.29 94.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.051 -0.522 . . . . 44.340000000000003 110.667 178.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.786 HD21 ' SD ' ' A' ' 37' ' ' MET . 45.3 tp -67.84 -32.6 73.24 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.257 -0.429 . . . . 71.439999999999998 110.831 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.42 -37.35 85.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.010000000000005 110.893 178.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -80.77 -30.69 36.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 72.319999999999993 110.888 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.512 ' HD2' HG23 ' A' ' 15' ' ' ILE . 6.6 t80 -82.07 -33.07 30.03 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.082 -0.508 . . . . 64.25 110.999 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 244' ' ' ASN . . . . . 0.454 ' HB3' HD11 ' A' ' 77' ' ' LEU . 9.9 t-20 -78.28 -38.71 41.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.416 -0.356 . . . . 72.420000000000002 111.177 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -63.8 -13.38 43.79 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.073 0.463 . . . . 42.25 111.482 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -54.02 -36.37 62.93 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.511 -0.768 . . . . 70.5 110.258 175.464 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -78.36 -5.55 52.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 74.099999999999994 111.958 -177.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -65.67 -29.82 75.97 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.402 -0.904 . . . . 64.409999999999997 111.578 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.5 p -65.07 -34.95 79.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.995 0.426 . . . . 61.340000000000003 111.298 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.2 t -92.35 7.74 41.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.419 -0.355 . . . . 71.310000000000002 111.298 -176.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 71.2 m -74.41 -40.16 62.18 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 116.737 -0.211 . . . . 63.009999999999998 111.386 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.55 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -151.41 -179.31 7.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.19 0.519 . . . . 74.010000000000005 111.731 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 7.9 pt-20 -94.42 -45.43 7.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.216 -0.902 . . . . 74.239999999999995 111.704 -173.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 41.2 p -106.1 157.87 17.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.369 -0.378 . . . . 70.129999999999995 110.227 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.577 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 11.2 ptmm? -66.84 -33.28 75.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.88 0.372 . . . . 73.340000000000003 110.237 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.11 -50.39 73.42 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.61 -0.723 . . . . 74.230000000000004 110.738 -179.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 97.8 mt-30 -78.66 -31.88 46.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.981 -0.554 . . . . 60.020000000000003 110.845 -177.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.7 ttt -64.96 -43.77 91.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.133 0.492 . . . . 74.329999999999998 110.194 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -63.09 -35.32 79.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.532 -0.758 . . . . 74.310000000000002 110.859 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.3 -11.5 60.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.222 -0.445 . . . . 60.149999999999999 111.197 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.59 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -113.44 -1.19 14.24 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.499 -0.319 . . . . 73.109999999999999 110.51 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.565 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 29.1 ttpp -55.4 -54.79 39.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.486 -0.324 . . . . 64.219999999999999 111.206 -176.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -68.41 -26.72 65.68 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.973 -0.291 . . . . 71.140000000000001 110.74 -178.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -73.54 -37.88 65.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.524 -0.307 . . . . 72.420000000000002 111.285 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.565 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 17.9 ptp -79.85 -30.21 40.26 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.297 -1.001 . . . . 72.140000000000001 108.297 177.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.402 ' HE1' ' N ' ' A' ' 78' ' ' ASP . 58.5 mtp -90.5 29.77 1.24 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.981 -1.008 . . . . 74.120000000000005 110.638 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -111.03 -32.91 6.64 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.958 -1.126 . . . . 75.140000000000001 107.958 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -87.16 -33.72 19.3 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.576 -1.193 . . . . 72.510000000000005 112.617 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -52.53 -52.52 54.39 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.987 -0.745 . . . . 74.450000000000003 108.987 177.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.517 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -65.45 -60.72 2.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.225 0.536 . . . . 70.409999999999997 110.829 174.263 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -88.82 62.96 6.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.811 -0.631 . . . . 72.329999999999998 112.04 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -147.76 -29.07 0.33 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 71.310000000000002 111.695 171.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.591 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -84.41 0.9 47.71 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.801 -0.814 . . . . 72.299999999999997 108.801 174.886 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -64.32 -53.87 42.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.414 -1.266 . . . . 74.25 110.676 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.25 -30.84 69.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.43 . . . . 73.129999999999995 111.818 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 276' ' ' MET . . . . . 0.493 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 60.1 mtm -84.87 -26.66 27.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.84 0.352 . . . . 54.399999999999999 110.602 -179.417 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 273' ' ' TYR . 3.7 tt -67.02 -33.92 76.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.016 -0.538 . . . . 73.430000000000007 109.784 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 278' ' ' ASP . . . . . 0.415 ' N ' ' HE1' ' A' ' 66' ' ' MET . 10.6 t70 -61.29 -44.18 97.65 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.837 -0.62 . . . . 64.230000000000004 110.831 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.34 65.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.391 -0.822 . . . . 65.230000000000004 111.159 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 280' ' ' ASN . . . . . 0.448 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 16.5 m120 -88.65 -15.91 33.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.046 -0.525 . . . . 73.439999999999998 110.344 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.404 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -75.5 -39.47 58.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 64.420000000000002 109.844 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 42.7 mt-10 -51.22 -39.59 56.9 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.374 -0.83 . . . . 73.400000000000006 111.934 -176.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -44.7 -47.81 10.66 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.939 0.774 . . . . 74.319999999999993 111.855 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -90.41 -29.86 17.75 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.249 -0.432 . . . . 73.239999999999995 111.017 -177.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.404 HG13 ' O ' ' B' ' 281' ' ' MET . 72.4 mt -64.37 -55.53 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 73.340000000000003 110.992 179.513 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.656 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -68.75 -17.63 64.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.283 -0.417 . . . . 54.439999999999998 111.664 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -107.95 9.46 28.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.921 0.341 . . . . 73.019999999999996 111.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -55.68 -45.73 77.73 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.792 0.329 . . . . 73.540000000000006 110.572 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 . . . . . 0 C--N 1.327 -0.411 0 CA-C-N 115.848 -0.615 . . . . 71.409999999999997 110.978 178.323 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.599 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 1.7 p-10 . . . . . 0 N--CA 1.453 -0.288 0 N-CA-C 109.665 -0.495 . . . . 71.299999999999997 109.665 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.91 -89.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 63.539999999999999 110.642 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -111.3 -22.34 11.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.833 -0.621 . . . . 72.439999999999998 110.183 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.69 160.96 17.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 75.329999999999998 111.192 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.456 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -85.41 49.98 1.86 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.236 -0.893 . . . . 63.43 111.769 -177.668 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.599 ' HD2' ' HB2' ' A' ' 3' ' ' ASN . 89.5 m-85 -52.19 -46.3 65.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.037 0.446 . . . . 74.349999999999994 111.321 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.53 -6.53 47.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 54.020000000000003 112.02 -174.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.558 ' HA ' ' NE ' ' A' ' 10' ' ' ARG . 4.1 mmp_? -96.37 -58.45 2.06 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 121.089 -0.244 . . . . 61.219999999999999 110.561 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.724 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -56.42 -20.35 19.29 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.626 0.602 . . . . 63.020000000000003 112.626 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.3 t -69.35 -23.34 63.75 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 121.03 -0.268 . . . . 71.439999999999998 111.334 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.559 ' HB2' HD11 ' B' ' 217' ' ' LEU . 59.9 mt-10 -80.66 -28.63 36.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.271 -0.641 . . . . 71.030000000000001 109.271 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.724 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -64.41 -43.19 95.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.246 -0.888 . . . . 72.209999999999994 109.6 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 78.2 mt -69.46 -25.17 28.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.547 -0.751 . . . . 61.329999999999998 110.55 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.468 ' HD2' ' HA ' ' A' ' 16' ' ' LYS . 22.2 mmmt -61.75 -38.51 88.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.374 -0.375 . . . . 74.430000000000007 111.872 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.499 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.1 tm? -65.4 -34.23 77.81 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.235 -0.654 . . . . 75.519999999999996 109.235 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.98 -35.94 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.584 -0.735 . . . . 74.329999999999998 110.393 -177.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -69.92 -12.3 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.969 -0.56 . . . . 62.25 111.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.29 -39.65 17.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.792 0.329 . . . . 74.25 110.692 175.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -76.35 -22.48 54.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.293 0.568 . . . . 64.109999999999999 110.259 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -73.23 -11.82 60.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 74.230000000000004 110.553 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -82.22 0.83 39.39 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 116.096 -0.502 . . . . 73.420000000000002 111.674 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -73.77 115.46 13.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.22 -0.659 . . . . 65.219999999999999 109.22 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -50.18 -41.6 49.65 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.794 1.035 . . . . 63.340000000000003 113.794 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -97.5 2.44 50.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.111 0.782 . . . . 73.340000000000003 113.111 -171.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.7 mt -104.66 157.54 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.568 -0.53 . . . . 73.450000000000003 109.568 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -96.45 167.61 11.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.555 -0.535 . . . . 74.209999999999994 109.555 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.7 m -60.52 -32.12 71.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.016 0.436 . . . . 62.439999999999998 109.871 174.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.697 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -59.46 -38.21 93.19 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.258 -0.883 . . . . 63.409999999999997 113.714 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -64.91 -36.79 85.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.163 0.506 . . . . 72.129999999999995 110.439 -176.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 17.8 t -73.74 -39.14 52.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.866 -0.607 . . . . 70.030000000000001 110.199 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m -59.56 -41.85 91.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.236 0.541 . . . . 71.019999999999996 110.248 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 37' ' ' MET . . . -69.4 -29.92 67.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.641 -0.709 . . . . 71.530000000000001 110.938 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.2 m -65.18 -38.08 89.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.021 0.439 . . . . 72.209999999999994 109.911 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.842 ' HB3' HD13 ' B' ' 240' ' ' LEU . 1.6 t80 -67.99 -34.37 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.849 -0.614 . . . . 72.200000000000003 109.753 177.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.756 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 0.8 OUTLIER -61.71 -53.49 55.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.364 -0.834 . . . . 72.400000000000006 110.762 177.156 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.46 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 24.2 t-105 -64.89 -40.24 94.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 74.230000000000004 111.012 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.38 93.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.343 -0.39 . . . . 72.450000000000003 111.241 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 48.3 tp -61.98 -38.18 87.6 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.593 -0.276 . . . . 52.140000000000001 110.285 178.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -61.82 -46.07 91.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 43.210000000000001 110.711 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -66.86 -39.75 87.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.191 -0.459 . . . . 64.510000000000005 111.059 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.711 ' HD2' HG23 ' B' ' 215' ' ' ILE . 11.0 t80 -76.94 -33.93 57.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.372 -0.377 . . . . 74.230000000000004 110.853 -176.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 9.8 t-20 -73.02 -43.3 62.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.217 -0.447 . . . . 75.140000000000001 110.759 -176.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.442 ' HB2' HD12 ' B' ' 277' ' ' LEU . . . -67.67 -18.61 65.0 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.175 -0.466 . . . . 71.530000000000001 111.335 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -59.01 -30.62 68.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.978 -0.555 . . . . 75.129999999999995 110.496 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -83.91 -10.11 58.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 73.109999999999999 111.282 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.77 -24.02 72.64 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.466 -0.873 . . . . 75.099999999999994 111.383 176.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.646 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 79.3 p -69.92 -15.15 63.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 63.109999999999999 111.355 -178.09 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.9 t -114.47 13.26 17.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 61.350000000000001 110.855 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -72.04 -35.09 69.25 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 116.505 -0.316 . . . . 53.310000000000002 111.501 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.651 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.2 m-85 -147.92 178.74 8.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.409 0.623 . . . . 53.219999999999999 112.387 -178.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.593 ' HG3' HG23 ' A' ' 54' ' ' THR . 15.1 pt-20 -91.7 -34.58 14.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.766 -1.107 . . . . 72.349999999999994 110.798 -171.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.614 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 80.5 p -124.71 159.3 31.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.498 -0.774 . . . . 74.409999999999997 109.219 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.657 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 6.6 pttm -78.67 -23.6 45.61 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.424 -0.51 . . . . 71.519999999999996 110.557 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.614 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.6 mp0 -61.34 -40.73 95.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.256 0.55 . . . . 63.32 109.808 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.768 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 95.0 mt-30 -83.52 -40.83 18.67 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.514 -0.766 . . . . 64.530000000000001 109.684 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.657 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 17.1 ttt -57.21 -44.55 83.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.755 -0.657 . . . . 72.409999999999997 111.605 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.611 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.3 tt0 -59.95 -39.34 85.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.343 -0.389 . . . . 72.129999999999995 111.052 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.68 -0.09 19.51 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.998 -0.547 . . . . 73.140000000000001 111.24 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.768 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.7 mmmt -112.47 -6.62 13.97 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.55 -0.295 . . . . 72.219999999999999 111.24 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 34.2 pttt -63.87 -43.34 96.38 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 119.996 -0.682 . . . . 72.019999999999996 110.146 -176.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.579 ' O ' ' HB2' ' A' ' 67' ' ' ASP . 21.5 mm-40 -83.16 3.19 31.89 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.033 0.444 . . . . 73.239999999999995 111.168 177.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -97.47 -32.83 11.63 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.651 -0.704 . . . . 73.310000000000002 110.426 171.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.407 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 16.7 ptp -85.15 -35.26 21.84 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.682 -0.859 . . . . 52.43 108.682 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.575 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 69.0 mtp -80.64 -18.83 46.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.727 -0.669 . . . . 74.349999999999994 111.091 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 22.7 t70 -47.74 -45.75 29.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.672 0.608 . . . . 75.340000000000003 111.038 -178.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -108.15 -4.92 17.23 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.399 -0.819 . . . . 73.400000000000006 111.115 -176.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.628 ' HD2' HD21 ' B' ' 277' ' ' LEU . 1.8 m-30 -59.22 -48.26 82.28 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 121.305 -0.158 . . . . 73.409999999999997 111.05 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.567 ' HE1' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.08 -51.58 63.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.166 0.507 . . . . 54.43 110.206 175.892 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.466 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 1.9 t70 -90.7 22.74 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.65 -0.704 . . . . 74.239999999999995 111.291 -171.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.587 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 3.2 mmm180 -84.71 -44.93 12.92 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.209 0.528 . . . . 70.239999999999995 110.251 -176.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.737 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -95.44 15.09 20.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.663 -0.699 . . . . 70.340000000000003 109.929 -179.107 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HD2' ' OD2' ' A' ' 71' ' ' ASP . 20.0 tttp -56.15 -61.87 2.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.377 -0.829 . . . . 73.109999999999999 110.345 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -67.38 -31.12 71.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.669 -0.696 . . . . 72.099999999999994 110.977 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.8 mtt -62.04 -38.86 90.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.349 0.595 . . . . 74.140000000000001 109.816 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.591 ' CD2' ' HE2' ' A' ' 81' ' ' MET . 1.6 tt -73.55 -42.28 61.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.298 -0.865 . . . . 73.230000000000004 109.499 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.456 ' N ' ' HE1' ' B' ' 266' ' ' MET . 4.9 t70 -57.67 -42.04 82.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.447 -0.797 . . . . 72.319999999999993 110.831 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.59 -16.05 59.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.416 -0.811 . . . . 61.039999999999999 112.233 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -105.06 -16.07 14.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.844 0.354 . . . . 72.120000000000005 110.492 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.591 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 14.0 mmt -67.6 -63.02 1.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.906 -0.588 . . . . 64.319999999999993 111.55 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.632 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 8.3 pt-20 -80.6 1.85 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.835 0.68 . . . . 72.409999999999997 112.835 -170.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.39 -49.67 76.91 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.152 -0.684 . . . . 61.420000000000002 109.152 171.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -72.86 -38.26 67.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.482 -0.781 . . . . 70.239999999999995 110.189 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.735 HG21 ' HB2' ' B' ' 259' ' ' GLN . 66.7 mt -58.97 -54.25 36.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.523 -0.762 . . . . 73.140000000000001 111.941 -176.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.626 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.1 pt-20 -66.48 -12.15 55.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.652 0.263 . . . . 72.519999999999996 111.673 -177.034 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -110.57 11.4 22.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.668 -0.242 . . . . 74.310000000000002 111.4 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.474 ' CE2' ' HA ' ' B' ' 254' ' ' THR . 8.5 t80 -52.71 -56.37 16.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.282 . . . . 74.340000000000003 110.294 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.913 -0.585 . . . . 74.040000000000006 110.911 -179.625 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.8 p-10 . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 120.634 0.255 . . . . 72.340000000000003 110.598 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -68.92 -77.69 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.016 0.436 . . . . 75.5 110.162 175.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -128.51 -31.15 2.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 74.230000000000004 110.323 176.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -86.68 179.35 6.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.733 -0.667 . . . . 54.299999999999997 111.339 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.54 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -79.68 43.93 0.6 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.433 -0.803 . . . . 75.420000000000002 112.674 -174.264 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.75 -43.39 85.37 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.667 0.247 . . . . 72.310000000000002 111.667 -177.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.96 -14.88 62.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.033 0.444 . . . . 53.119999999999997 111.447 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.54 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 1.4 mmp_? -91.0 -62.16 1.51 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.343 -0.39 . . . . 74.230000000000004 110.17 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.836 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.37 -25.77 37.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.699 0.629 . . . . 33.049999999999997 112.699 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 212' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -67.97 -21.16 65.09 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.764 0.316 . . . . 73.5 110.946 -178.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.409 ' HB2' HD11 ' A' ' 17' ' ' LEU . 50.7 mt-10 -84.64 -27.58 27.06 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.619 -0.511 . . . . 74.319999999999993 109.619 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.836 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -62.44 -41.32 98.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.514 -0.767 . . . . 73.510000000000005 109.43 176.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.711 HG23 ' HD2' ' A' ' 43' ' ' TYR . 87.5 mt -68.8 -22.83 26.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.204 -0.907 . . . . 73.209999999999994 111.027 178.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' B' ' 212' ' ' THR . 30.6 mmmt -66.58 -40.42 88.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 73.340000000000003 111.603 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.559 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -62.47 -35.98 81.04 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.058 -0.719 . . . . 65.239999999999995 109.058 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 218' ' ' ALA . . . . . 0.425 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -67.84 -37.42 81.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.731 -0.668 . . . . 54.240000000000002 110.145 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.412 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 29.2 m-80 -74.37 -6.49 48.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.99 -0.55 . . . . 72.099999999999994 111.509 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -93.98 -32.81 13.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.368 . . . . 73.430000000000007 110.789 175.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -75.78 -27.09 57.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.508 0.671 . . . . 74.120000000000005 109.689 175.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -71.72 -12.76 61.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.985 -1.007 . . . . 74.409999999999997 110.481 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 86.9 mm-40 -75.22 -15.04 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.102 -0.499 . . . . 73.430000000000007 111.578 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.644 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.1 t-20 -71.56 122.45 20.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.189 0.519 . . . . 54.25 109.719 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -65.66 -30.28 70.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.241 -0.89 . . . . 63.340000000000003 112.162 -174.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.14 -1.33 45.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.443 0.534 . . . . 71.329999999999998 112.443 -172.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.644 HG13 ' HB3' ' B' ' 224' ' ' ASN . 8.9 mt -99.2 148.63 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.358 -0.608 . . . . 53.399999999999999 109.358 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.813 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 42.7 mt-30 -78.21 147.38 34.47 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.859 -0.609 . . . . 75.230000000000004 109.865 178.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 3.8 m -59.82 -34.63 73.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.041 0.448 . . . . 72.519999999999996 110.662 -178.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.28 87.68 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.861 -0.609 . . . . 75.25 113.816 -176.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.813 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 16.8 mm-40 -80.49 -29.52 37.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.842 0.821 . . . . 54.109999999999999 109.674 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 232' ' ' VAL . . . . . 0.425 HG11 ' O ' ' B' ' 218' ' ' ALA . 27.7 t -77.35 -41.34 29.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.27 -0.877 . . . . 71.109999999999999 110.938 -176.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.8 p -62.27 -40.16 95.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 72.109999999999999 110.816 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.45 75.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.899 -0.591 . . . . 74.150000000000006 110.934 179.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 64.0 m -65.06 -34.24 77.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 63.219999999999999 110.715 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.538 ' CD1' HD12 ' A' ' 14' ' ' LEU . 5.3 t80 -65.83 -36.65 84.07 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.309 0.576 . . . . 55.530000000000001 109.808 178.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.737 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.6 ttm -69.52 -48.39 60.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.751 -0.658 . . . . 64.030000000000001 111.547 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.456 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 34.9 t-105 -63.33 -35.04 79.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.327 . . . . 72.519999999999996 110.782 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.487 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.95 -40.49 95.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 75.120000000000005 110.894 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.842 HD13 ' HB3' ' A' ' 36' ' ' PHE . 43.8 tp -69.1 -32.13 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.979 0.418 . . . . 74.340000000000003 110.399 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.447 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -63.06 -41.4 99.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.901 -0.591 . . . . 63.140000000000001 110.829 178.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -75.3 -26.65 58.88 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.15 0.5 . . . . 74.219999999999999 110.275 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -81.4 -36.52 29.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.716 -0.674 . . . . 55.020000000000003 110.854 -176.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -74.76 -27.82 60.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.659 0.266 . . . . 72.319999999999993 111.376 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.54 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -71.98 -16.0 62.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.243 0.544 . . . . 61.5 111.105 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -55.88 -33.68 64.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 73.310000000000002 110.256 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.697 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 56.3 m-85 -71.63 -13.59 61.8 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.019 -0.537 . . . . 53.340000000000003 112.173 -177.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.0 87.82 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.254 -0.974 . . . . 74.239999999999995 111.489 177.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 249' ' ' SER . . . . . 0.461 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 6.1 m -59.96 -30.96 69.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.814 0.34 . . . . 75.099999999999994 111.732 -177.721 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.0 t -102.26 16.86 24.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.056 0.455 . . . . 44.409999999999997 111.038 -176.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 22.9 t -78.01 -66.05 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.323 -0.399 . . . . 72.030000000000001 110.89 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.626 ' CD1' ' HG3' ' B' ' 261' ' ' LYS . 2.4 m-85 -135.15 -169.99 2.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.293 0.568 . . . . 71.310000000000002 112.511 -174.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.733 ' HG3' ' H ' ' B' ' 254' ' ' THR . 5.4 pt-20 -95.82 -61.16 1.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.854 -1.066 . . . . 71.150000000000006 110.154 -177.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.733 ' H ' ' HG3' ' B' ' 253' ' ' GLU . 74.8 p -89.81 154.41 19.92 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.89 -0.596 . . . . 74.109999999999999 110.461 -177.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 10.4 ptmm? -71.5 -26.82 62.84 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.753 -0.379 . . . . 72.510000000000005 110.534 -177.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.8 -51.18 70.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.045 -0.525 . . . . 71.340000000000003 110.402 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.652 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 95.1 mt-30 -77.47 -40.72 42.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 63.420000000000002 110.063 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.461 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 21.5 ttt -57.79 -40.66 80.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.433 -0.803 . . . . 52.32 111.179 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.735 ' HB2' HG21 ' A' ' 85' ' ' ILE . 30.1 tt0 -71.34 -29.44 64.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.443 . . . . 74.209999999999994 111.44 -178.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.25 -15.54 59.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.011 0.434 . . . . 73.150000000000006 110.872 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.9 mmmt -95.66 -7.59 37.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.281 -0.418 . . . . 71.340000000000003 111.414 -174.368 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.566 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 56.6 pttt -58.14 -47.08 84.43 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.432 -0.349 . . . . 71.319999999999993 110.763 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.553 ' O ' ' HB2' ' B' ' 267' ' ' ASP . 8.3 mm100 -74.67 -16.05 60.78 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.461 -0.496 . . . . 70.409999999999997 111.623 -178.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -80.39 -32.59 37.53 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.779 -0.369 . . . . 74.5 110.407 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.566 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 15.3 ptp -89.73 -26.44 20.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.379 -0.6 . . . . 54.409999999999997 109.379 178.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.489 ' HG2' HD22 ' A' ' 77' ' ' LEU . 83.8 mtp -85.02 -20.68 30.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.788 -0.642 . . . . 25.350000000000001 111.615 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 267' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 9.0 t70 -52.35 -47.64 65.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.485 0.66 . . . . 75.200000000000003 110.404 -175.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.45 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 8.8 p90 -96.83 0.12 48.78 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.316 -0.856 . . . . 72.510000000000005 110.858 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.465 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.2 m-30 -68.39 -50.52 52.4 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.702 -0.851 . . . . 74.049999999999997 108.702 171.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.502 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -53.36 -55.94 20.81 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.589 -0.732 . . . . 64.510000000000005 109.868 171.347 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -95.65 74.2 3.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.468 0.651 . . . . 64.129999999999995 111.385 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 4.6 mtm180 -127.71 -38.41 1.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.862 -0.608 . . . . 71.510000000000005 109.819 168.299 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.756 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.84 11.78 36.16 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.157 -0.474 . . . . 73.019999999999996 110.874 -176.786 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -64.46 -53.14 52.92 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.679 -0.408 . . . . 74.430000000000007 110.811 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.55 -35.31 80.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 62.310000000000002 110.866 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 276' ' ' MET . . . . . 0.46 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 59.8 mtt -62.73 -43.65 98.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.628 0.727 . . . . 62.210000000000001 109.927 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.628 HD21 ' HD2' ' A' ' 69' ' ' TYR . 28.3 tp -70.25 -41.45 73.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.779 -1.101 . . . . 74.299999999999997 110.514 -178.014 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.14 -46.49 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.544 0.687 . . . . 52.409999999999997 110.102 178.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.08 -24.02 63.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.838 -1.073 . . . . 63.109999999999999 111.669 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.41 -32.15 22.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.998 -0.281 . . . . 71.140000000000001 110.654 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.571 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -60.55 -62.92 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.051 -0.522 . . . . 74.010000000000005 110.598 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.608 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 10.6 pt-20 -74.29 -7.27 52.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.857 -0.611 . . . . 74.329999999999998 112.154 -172.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -58.63 -48.04 82.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.149 0.5 . . . . 71.319999999999993 110.051 174.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -87.5 -15.63 37.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.308 -0.405 . . . . 73.549999999999997 111.197 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.611 HD13 ' HA ' ' A' ' 59' ' ' GLN . 57.5 mt -70.35 -55.95 12.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 C-N-CA 121.019 -0.272 . . . . 72.420000000000002 110.354 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.3 pt-20 -57.8 -30.49 65.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.81 0.338 . . . . 73.439999999999998 111.383 -178.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -94.4 6.75 47.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.334 -0.394 . . . . 72.329999999999998 111.61 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -57.81 -44.71 86.56 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.92 -0.4 . . . . 71.120000000000005 109.92 178.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.921 0.391 . . . . 72.219999999999999 110.757 176.42 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.56 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.4 p-10 . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.986 -0.376 . . . . 73.109999999999999 109.986 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -84.13 -77.29 0.27 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.58 -0.282 . . . . 52.109999999999999 111.253 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -105.34 -50.73 3.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.276 0.56 . . . . 70.519999999999996 109.845 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.56 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -97.28 161.52 13.76 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.476 -0.784 . . . . 64.319999999999993 110.863 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -78.75 53.76 1.41 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.832 -0.622 . . . . 62.340000000000003 112.091 -179.121 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.444 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 28.6 m-85 -53.79 -41.32 67.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.973 0.416 . . . . 71.409999999999997 110.961 -178.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.93 -5.02 31.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.8 -0.636 . . . . 33.140000000000001 112.24 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -99.37 -61.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.771 -0.455 . . . . 72.420000000000002 109.771 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.32 -23.51 24.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.731 -0.668 . . . . 71.030000000000001 112.682 -178.218 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.0 t -65.26 -25.58 67.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.473 0.178 . . . . 71.25 111.06 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.537 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.8 mt-10 -82.16 -33.23 29.62 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.519 0.676 . . . . 63.450000000000003 109.183 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.73 -45.15 91.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.913 -1.04 . . . . 72.299999999999997 109.443 177.002 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.505 HG23 ' HD2' ' B' ' 243' ' ' TYR . 71.9 mt -68.91 -31.38 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.615 -0.72 . . . . 63.020000000000003 110.682 176.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.48 -38.59 81.24 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.19 -0.459 . . . . 72.209999999999994 110.828 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.627 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 2.0 tm? -67.63 -39.74 84.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 64.540000000000006 110.135 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.585 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -61.2 -25.52 67.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.255 0.55 . . . . 71.549999999999997 110.739 177.3 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.413 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 22.8 m-80 -80.51 -19.97 44.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.987 -0.551 . . . . 54.119999999999997 110.141 178.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.627 ' HG2' ' HA ' ' A' ' 17' ' ' LEU . 27.6 mm-40 -68.33 -51.38 45.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.411 0.624 . . . . 61.200000000000003 109.522 177.1 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -73.82 -14.69 61.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.159 -0.928 . . . . 74.310000000000002 110.362 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -81.18 -11.64 59.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.744 -0.662 . . . . 62.340000000000003 110.854 -178.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 8.6 mm-40 -78.88 64.02 3.73 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.295 0.569 . . . . 73.219999999999999 110.352 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -147.55 149.36 32.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.502 -0.772 . . . . 74.510000000000005 109.053 -178.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.2 t -103.54 -31.77 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 111.979 0.362 . . . . 74.129999999999995 111.979 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -87.29 2.69 49.45 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.155 0.428 . . . . 73.299999999999997 112.155 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.92 148.93 16.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.8 -0.445 . . . . 71.030000000000001 109.8 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.519 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 2.3 mp0 -83.45 146.79 28.21 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.993 -0.548 . . . . 71.420000000000002 109.631 178.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 38.8 m -59.04 -34.79 72.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.125 0.488 . . . . 63.43 110.785 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.4 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -71.86 -11.57 73.94 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.746 -0.661 . . . . 54.240000000000002 113.32 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 13.3 mm-40 -74.54 -23.31 58.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.297 0.57 . . . . 74.400000000000006 110.037 -179.017 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.585 HG11 ' O ' ' A' ' 18' ' ' ALA . 21.2 t -87.3 -39.08 12.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.636 -0.711 . . . . 53.530000000000001 109.834 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -57.56 -42.05 82.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.688 -0.687 . . . . 24.34 110.746 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.11 -31.28 72.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 73.439999999999998 110.908 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.536 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 50.0 m -66.96 -32.3 73.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.159 0.504 . . . . 74.409999999999997 109.901 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.495 ' CD1' HD12 ' B' ' 214' ' ' LEU . 7.1 t80 -68.47 -37.68 80.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 72.519999999999996 109.854 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.779 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 8.5 ttm -66.86 -45.22 78.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 65.329999999999998 111.324 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.661 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 23.7 t-105 -63.1 -38.21 90.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.988 0.423 . . . . 71.219999999999999 110.565 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.509 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -66.39 -36.8 83.76 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.07 -0.514 . . . . 44.109999999999999 111.242 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 61.4 tp -67.68 -35.52 79.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.946 -0.391 . . . . 72.540000000000006 109.946 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.424 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.0 -43.59 98.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.81 -0.632 . . . . 73.209999999999994 110.9 178.269 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -69.88 -39.15 76.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.025 0.441 . . . . 75.129999999999995 110.708 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -72.41 -32.07 66.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.975 -0.557 . . . . 64.109999999999999 110.497 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 7.1 t-20 -77.31 -39.28 48.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.003 -0.544 . . . . 74.439999999999998 110.722 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.74 -27.59 69.3 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.12 0.486 . . . . 74.319999999999993 111.006 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 18.6 t90 -58.55 -27.77 64.88 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.253 -0.885 . . . . 71.519999999999996 111.072 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.83 -1.72 40.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.544 -0.298 . . . . 74.310000000000002 111.639 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.09 -27.53 69.06 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.463 -0.875 . . . . 72.299999999999997 111.37 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.58 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 33.9 p -67.34 -17.7 64.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 43.43 111.572 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 p -94.52 0.69 55.47 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.958 0.409 . . . . 54.439999999999998 110.894 -177.182 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.4 t -81.17 -39.03 26.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 63.109999999999999 111.59 -175.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.414 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.3 m-85 -154.13 -179.05 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.246 0.461 . . . . 73.239999999999995 112.246 -175.58 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 54' ' ' THR . 8.9 pt-20 -101.79 -47.32 4.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.41 -0.814 . . . . 75.129999999999995 111.284 -176.315 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.451 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 51.9 p -96.41 154.77 17.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.511 -0.313 . . . . 63.340000000000003 110.358 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.506 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 17.1 ptmt -68.42 -31.16 70.3 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.844 -0.343 . . . . 71.439999999999998 110.287 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.7 mp0 -58.21 -52.24 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.281 0.562 . . . . 75.319999999999993 110.606 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.681 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 95.9 mt-30 -76.91 -36.64 56.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.746 -0.661 . . . . 71.540000000000006 110.541 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.58 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 22.7 ttt -64.86 -43.36 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 70.439999999999998 111.092 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.528 ' HG3' ' NZ ' ' A' ' 62' ' ' LYS . 32.5 tt0 -61.56 -38.68 88.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.021 -0.536 . . . . 74.230000000000004 111.406 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.21 -8.7 57.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.714 -175.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.681 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.2 mmmm -104.02 -0.24 29.05 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 120.881 -0.328 . . . . 73.329999999999998 111.119 -175.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 6.6 ptpp? -59.52 -48.44 81.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.695 -0.402 . . . . 73.120000000000005 110.607 -176.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.592 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 5.0 tp-100 -73.4 -24.52 60.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.961 -0.385 . . . . 64.319999999999993 109.961 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -71.35 -43.45 66.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 73.310000000000002 111.19 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.2 ptp -75.19 -34.34 61.51 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.911 -0.774 . . . . 63.109999999999999 108.911 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.411 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 63.9 mtp -82.15 1.28 37.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.508 -0.769 . . . . 74.329999999999998 111.289 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 26.1 t0 -78.86 -27.47 44.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.987 0.422 . . . . 75.329999999999998 110.512 -175.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.631 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 24.6 p90 -119.38 -8.59 10.03 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.652 -0.419 . . . . 73.099999999999994 111.258 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.2 m-30 -54.57 -48.34 72.2 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.625 0.25 . . . . 75.400000000000006 111.472 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.782 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -52.3 -57.54 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.994 -0.548 . . . . 74.450000000000003 111.54 177.875 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.493 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 9.1 t70 -91.47 62.74 4.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.952 -0.567 . . . . 61.509999999999998 111.066 -172.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 4.2 mmp_? -120.12 -38.01 2.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 73.25 110.923 175.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.822 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -90.22 12.2 18.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.129 0.49 . . . . 73.019999999999996 109.726 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -51.81 -66.86 0.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.834 -1.076 . . . . 62.109999999999999 111.098 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.0 -23.16 64.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.75 -0.659 . . . . 70.25 112.266 -174.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.434 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 28.2 mtm -78.13 -28.14 48.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.297 0.57 . . . . 71.209999999999994 109.619 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.751 HD21 ' HE2' ' A' ' 81' ' ' MET . 6.6 tt -76.08 -37.59 58.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.438 -0.801 . . . . 74.299999999999997 108.887 174.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.424 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 11.3 t70 -55.76 -39.33 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.055 -0.975 . . . . 71.420000000000002 111.069 178.201 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.96 -20.32 66.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.283 -0.871 . . . . 70.530000000000001 111.974 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -104.3 -4.47 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 121.065 -0.254 . . . . 54.329999999999998 111.382 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.751 ' HE2' HD21 ' A' ' 77' ' ' LEU . 9.5 mmt -71.56 -35.41 70.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.637 -0.256 . . . . 64.209999999999994 111.611 -178.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.895 ' HA ' HD12 ' A' ' 85' ' ' ILE . 41.2 mt-10 -72.58 4.03 4.34 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.003 0.371 . . . . 74.219999999999999 112.003 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.34 127.2 30.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.401 -0.592 . . . . 51.43 109.401 170.848 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' TYR . . . . . 0.537 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 23.0 m-85 77.5 -0.12 2.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.83 -1.077 . . . . 63.130000000000003 110.997 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 82' ' ' GLU . 11.2 mt -92.68 -66.02 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.108 -0.496 . . . . 65.510000000000005 109.687 176.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.26 -18.54 65.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.269 0.557 . . . . 63.229999999999997 110.151 176.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -100.8 0.6 39.02 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.617 -0.72 . . . . 71.219999999999999 111.152 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.76 -47.6 85.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 120.589 0.233 . . . . 75.540000000000006 110.614 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 62.109999999999999 111.412 178.983 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.592 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 84.4 m-20 . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 121.221 0.534 . . . . 72.239999999999995 111.482 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -120.68 -58.69 1.81 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.32 -0.855 . . . . 75.239999999999995 109.677 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -122.03 -49.06 2.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.104 0.478 . . . . 63.0 110.28 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -99.85 166.63 10.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.798 -0.637 . . . . 55.539999999999999 111.74 -177.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.592 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -78.84 53.99 1.47 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 74.040000000000006 111.708 178.126 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' B' ' 206' ' ' ALA . 71.1 m-85 -54.49 -45.6 73.28 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 72.209999999999994 111.753 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.5 -15.34 62.56 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.431 0.53 . . . . 62.299999999999997 112.431 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -87.74 -62.33 1.52 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.576 0.227 . . . . 75.129999999999995 110.506 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.836 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.6 -18.91 22.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.877 0.695 . . . . 65.420000000000002 112.877 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 212' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 13.6 t -66.76 -23.16 66.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.695 0.284 . . . . 73.019999999999996 110.738 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.493 ' HB2' HD11 ' A' ' 17' ' ' LEU . 79.4 mt-10 -84.55 -27.46 27.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.387 0.613 . . . . 71.530000000000001 109.379 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.836 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -67.23 -47.27 71.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.202 -0.908 . . . . 62.409999999999997 109.598 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 74.6 mt -68.9 -30.92 48.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.661 -0.699 . . . . 65.299999999999997 110.27 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' B' ' 212' ' ' THR . 10.2 tmtt? -56.31 -40.03 73.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.796 -0.638 . . . . 72.120000000000005 110.88 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -64.61 -45.21 87.9 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.576 -0.527 . . . . 73.409999999999997 109.576 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.85 -37.08 78.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.98 -0.555 . . . . 71.099999999999994 110.835 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -74.52 11.56 0.98 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.053 -0.521 . . . . 71.219999999999999 111.757 178.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.11 -37.72 6.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.16 0.505 . . . . 72.25 109.733 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -76.83 -38.32 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 71.540000000000006 110.835 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 222' ' ' ASN . . . . . 0.455 ' CA ' HG21 ' B' ' 232' ' ' VAL . 56.3 t30 -71.29 -14.59 62.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.63 -0.714 . . . . 71.219999999999999 111.55 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -74.71 1.22 12.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.453 -0.34 . . . . 60.439999999999998 111.315 -176.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.492 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.1 t-20 -77.69 103.95 7.94 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.61 -0.885 . . . . 72.200000000000003 108.61 174.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.9 t -58.64 -36.66 74.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.594 -0.73 . . . . 72.109999999999999 112.888 -172.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -82.57 9.55 9.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.964 0.357 . . . . 74.319999999999993 111.964 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.492 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.5 mt -117.28 152.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 109.768 -0.456 . . . . 72.319999999999993 109.768 175.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.0 154.43 28.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.087 -0.506 . . . . 71.239999999999995 110.169 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 229' ' ' THR . . . . . 0.407 ' HA ' ' OD1' ' B' ' 222' ' ' ASN . 5.5 m -64.43 -30.81 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.978 0.418 . . . . 65.049999999999997 110.501 179.037 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -68.05 -18.15 70.58 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.825 -0.625 . . . . 35.32 113.318 -178.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -71.23 -20.21 62.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.991 0.424 . . . . 72.049999999999997 111.078 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 232' ' ' VAL . . . . . 0.455 HG21 ' CA ' ' B' ' 222' ' ' ASN . 28.6 t -99.12 -36.76 5.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.085 -0.507 . . . . 70.450000000000003 110.478 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 35.9 p -64.16 -40.99 97.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.03 0.443 . . . . 64.310000000000002 110.52 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.38 73.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.989 -0.55 . . . . 61.439999999999998 110.554 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.405 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 56.4 m -68.12 -36.49 79.82 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.744 -0.465 . . . . 54.0 109.744 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.53 -40.73 85.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.751 -0.659 . . . . 75.450000000000003 109.58 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.822 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 14.8 ttm -66.25 -44.13 84.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.685 -0.689 . . . . 64.129999999999995 111.457 178.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.444 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 22.7 t-105 -64.31 -38.91 92.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.329999999999998 110.445 176.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.514 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.7 -39.08 93.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 111.065 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.17 -35.83 78.65 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.615 -0.513 . . . . 74.409999999999997 109.615 177.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -62.88 -30.65 71.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.175 -0.466 . . . . 61.439999999999998 111.406 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -88.59 -33.25 17.74 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.871 -0.332 . . . . 74.040000000000006 110.949 179.071 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.505 ' HD2' HG23 ' A' ' 15' ' ' ILE . 10.7 t80 -81.56 -39.64 24.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.392 -0.367 . . . . 72.400000000000006 111.233 -175.692 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -78.82 -17.43 55.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.047 0.451 . . . . 73.129999999999995 110.975 -175.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -74.75 -13.95 60.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.233 0.539 . . . . 70.129999999999995 110.57 177.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -60.63 -25.93 66.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.513 -0.767 . . . . 65.219999999999999 110.533 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.4 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 63.4 m-85 -72.77 -8.63 56.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.862 -0.608 . . . . 73.450000000000003 111.762 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 248' ' ' GLY . . . . . 0.747 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.03 -36.4 67.34 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.508 -0.853 . . . . 74.219999999999999 111.816 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 43.9 p -69.8 -13.63 62.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.815 0.34 . . . . 72.5 111.831 -177.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 40.0 p -93.03 -9.82 38.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.39 . . . . 72.409999999999997 110.784 -178.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.7 t -76.5 -36.56 57.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.244 -0.435 . . . . 51.530000000000001 110.772 -175.272 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.403 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 1.4 m-85 -148.88 -178.5 6.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.126 0.489 . . . . 72.010000000000005 111.919 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.527 ' HG3' HG23 ' B' ' 254' ' ' THR . 10.3 pt-20 -103.93 -33.41 8.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.136 -0.938 . . . . 74.310000000000002 111.779 -172.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.536 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 43.2 p -115.09 158.48 22.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.869 -0.605 . . . . 75.450000000000003 110.158 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.77 -36.06 79.81 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 121.052 -0.259 . . . . 63.240000000000002 110.792 -178.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 256' ' ' GLU . . . . . 0.536 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.6 mp0 -58.27 -50.97 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.282 0.563 . . . . 73.25 110.188 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.618 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 97.9 mt-30 -73.05 -40.86 64.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.471 -0.786 . . . . 75.209999999999994 110.82 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.448 ' SD ' HG12 ' A' ' 85' ' ' ILE . 20.1 ttt -63.88 -47.38 80.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 74.319999999999993 111.24 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.547 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.7 tt0 -62.0 -34.48 76.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 63.240000000000002 110.909 -178.191 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.32 -6.77 48.24 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.113 -0.494 . . . . 45.240000000000002 111.58 -178.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.618 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 13.9 mmmm -114.59 5.49 15.47 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 122.362 -0.211 . . . . 53.020000000000003 110.608 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.473 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 1.6 ptpp? -52.55 -48.34 66.19 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 123.314 0.384 . . . . 64.409999999999997 110.785 -177.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 16.1 tp60 -77.78 -28.36 50.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.99 0.424 . . . . 62.409999999999997 110.055 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.67 -38.17 83.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.748 -0.66 . . . . 61.100000000000001 111.187 -177.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.747 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 16.8 ptp -84.44 -26.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.307 0.575 . . . . 74.109999999999999 109.83 -177.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.523 ' HG2' HD22 ' A' ' 77' ' ' LEU . 75.0 mtp -79.1 -20.46 48.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.643 -0.708 . . . . 70.140000000000001 111.758 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.41 -34.95 74.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 75.200000000000003 111.369 -168.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -102.79 -10.61 18.97 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.787 -0.365 . . . . 74.439999999999998 111.179 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -60.35 -48.13 83.08 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.477 0.18 . . . . 51.399999999999999 111.173 -178.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.81 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -51.65 -51.77 53.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.059 -0.519 . . . . 75.519999999999996 111.088 177.067 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 271' ' ' ASP . . . . . 0.662 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 10.4 t70 -92.2 28.75 1.81 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.831 -0.622 . . . . 45.109999999999999 111.558 -171.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -84.28 -48.28 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.945 -0.472 . . . . 73.540000000000006 110.765 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.782 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -83.85 10.49 9.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.113 -0.494 . . . . 74.510000000000005 110.981 -174.822 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 14.4 tttp -56.07 -60.57 3.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.946 -0.57 . . . . 73.430000000000007 110.782 -177.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 275' ' ' GLU . . . . . 0.473 ' HG3' ' N ' ' B' ' 276' ' ' MET . 6.0 pt-20 -56.82 -39.83 74.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.602 -0.726 . . . . 74.120000000000005 111.842 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 276' ' ' MET . . . . . 0.661 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 49.3 mtm -74.66 -26.21 59.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.044 0.45 . . . . 44.119999999999997 110.548 -176.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 5.2 tt -72.41 -41.69 65.96 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.711 -0.848 . . . . 75.549999999999997 108.711 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 278' ' ' ASP . . . . . 0.411 ' N ' ' HE1' ' A' ' 66' ' ' MET . 8.7 t70 -61.37 -38.68 87.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.237 -0.892 . . . . 71.019999999999996 110.815 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -64.39 -17.35 63.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.656 -0.702 . . . . 35.200000000000003 111.779 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -101.09 -3.37 29.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.758 0.313 . . . . 71.530000000000001 111.283 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.41 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.1 mmt -76.38 -176.03 3.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.242 -0.435 . . . . 73.420000000000002 110.675 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.769 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 4.0 mm-40 61.54 14.81 6.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.483 -0.78 . . . . 75.109999999999999 111.901 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -66.76 -58.84 4.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.201 -0.454 . . . . 63.539999999999999 110.676 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -89.29 -7.46 55.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.977 0.417 . . . . 72.540000000000006 110.002 174.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.769 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 42.7 mt -75.44 -57.88 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.087 -0.506 . . . . 74.319999999999993 111.318 -175.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.5 pt-20 -73.03 -16.71 61.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.838 0.351 . . . . 72.239999999999995 110.595 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 287' ' ' ASN . . . . . 0.403 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 56.4 m-80 -109.19 22.19 16.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.289 -0.414 . . . . 64.430000000000007 110.516 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.506 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 25.3 t80 -58.6 -56.78 17.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.47 -0.332 . . . . 75.329999999999998 110.826 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.536 -0.302 . . . . 73.519999999999996 111.364 -179.101 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.697 ' HA ' ' HB2' ' A' ' 8' ' ' TYR . 1.6 p-10 . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.759 -0.83 . . . . 74.310000000000002 108.759 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . 0.461 ' H ' ' HD2' ' A' ' 8' ' ' TYR . 24.8 mt-10 -104.33 79.08 1.55 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.25 -0.432 . . . . 62.030000000000001 111.544 -175.01 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.43 24.67 8.77 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.125 0.965 . . . . 75.219999999999999 108.735 175.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -158.3 174.91 14.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.41 -1.268 . . . . 71.030000000000001 110.222 -171.053 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -91.49 42.4 1.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.308 -0.405 . . . . 64.310000000000002 111.526 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.697 ' HB2' ' HA ' ' A' ' 3' ' ' ASN . 44.5 m-85 -53.34 -46.3 69.46 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.413 -0.358 . . . . 54.130000000000003 111.193 178.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.12 -14.91 62.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.95 -0.568 . . . . 51.009999999999998 111.914 -178.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.444 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 0.6 OUTLIER -95.36 -58.02 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.257 -0.275 . . . . 72.420000000000002 110.257 178.905 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.889 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -57.16 -23.14 45.44 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.688 0.625 . . . . 51.530000000000001 112.688 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 t -65.39 -24.01 67.11 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.941 0.401 . . . . 70.040000000000006 110.801 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.544 ' HB2' HD11 ' B' ' 217' ' ' LEU . 35.9 mt-10 -81.34 -23.28 37.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.332 0.586 . . . . 73.209999999999994 109.878 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.889 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -71.14 -41.68 70.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.333 -0.848 . . . . 75.030000000000001 109.591 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.425 HG23 ' HD2' ' B' ' 243' ' ' TYR . 71.4 mt -72.67 -20.58 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.657 -0.701 . . . . 75.310000000000002 110.192 177.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 15.7 mmmt -57.96 -40.08 79.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.708 -0.678 . . . . 70.310000000000002 111.851 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' B' ' 213' ' ' GLU . 2.7 tm? -74.98 -29.73 60.98 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.267 0.556 . . . . 72.439999999999998 109.527 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.418 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -70.4 -42.95 71.02 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.585 -0.734 . . . . 51.5 110.698 -175.113 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.655 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.8 m-20 -57.05 -42.45 80.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.893 -0.594 . . . . 64.109999999999999 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.92 -33.96 75.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.939 -0.573 . . . . 75.519999999999996 111.745 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -77.62 -27.99 51.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.001 0.429 . . . . 74.140000000000001 110.199 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.498 ' HA ' HG21 ' A' ' 32' ' ' VAL . 52.7 t30 -74.7 -20.28 59.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.94 -0.573 . . . . 74.140000000000001 110.383 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 9.9 mm-40 -71.91 -15.58 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.962 -0.563 . . . . 64.219999999999999 111.296 -178.533 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.616 ' HB3' HG13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -66.69 123.51 20.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.963 0.411 . . . . 61.450000000000003 110.569 -177.226 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.2 t -56.98 -37.2 71.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.368 -0.833 . . . . 74.239999999999995 113.039 -175.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -82.74 -24.09 33.71 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.852 0.316 . . . . 75.0 111.852 -173.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.616 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.5 mt -90.68 145.11 7.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.095 0.474 . . . . 70.120000000000005 110.276 -174.34 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.708 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 33.4 mt-30 -83.73 152.65 24.59 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.322 -0.854 . . . . 71.319999999999993 109.358 177.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.445 ' HA ' ' OD1' ' A' ' 22' ' ' ASN . 30.2 m -58.3 -37.7 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.033 0.445 . . . . 72.0 110.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.844 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -69.39 -19.08 74.08 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.6 -0.727 . . . . 72.25 114.078 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.708 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 33.7 mm-40 -74.92 -36.09 62.17 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 117.588 0.694 . . . . 71.310000000000002 109.606 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.498 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.5 t -71.92 -41.04 69.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.312 -0.858 . . . . 74.209999999999994 110.353 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -59.38 -37.08 77.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.714 -0.675 . . . . 73.209999999999994 110.369 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.64 -31.48 65.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.798 -0.637 . . . . 72.010000000000005 110.872 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.483 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 10.3 t -68.33 -37.54 80.64 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.694 -0.484 . . . . 72.0 109.694 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.616 ' HD1' HD12 ' B' ' 214' ' ' LEU . 13.7 t80 -66.89 -37.47 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 72.109999999999999 109.545 176.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.731 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.4 ttm -67.33 -46.63 72.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 61.020000000000003 111.412 178.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.631 ' HE3' ' HB3' ' B' ' 276' ' ' MET . 35.8 t-105 -62.24 -39.93 94.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.739 0.304 . . . . 72.319999999999993 110.727 177.469 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.522 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -63.14 -37.89 88.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.362 -0.381 . . . . 72.099999999999994 111.038 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.753 HD21 ' SD ' ' B' ' 237' ' ' MET . 56.4 tp -64.94 -37.93 89.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 120.955 0.407 . . . . 70.5 110.075 178.447 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.549 ' HB1' ' HA ' ' B' ' 277' ' ' LEU . . . -63.16 -35.41 80.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.797 -0.638 . . . . 74.430000000000007 111.25 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 38' ' ' TRP . 55.9 mtp180 -74.81 -37.45 62.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.258 0.551 . . . . 74.120000000000005 110.142 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -77.39 -41.25 40.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.471 -0.786 . . . . 75.530000000000001 110.911 -175.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -66.05 -34.74 78.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.945 -0.57 . . . . 52.409999999999997 110.862 -175.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.403 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -62.37 -11.07 13.44 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.851 -0.613 . . . . 71.209999999999994 112.471 -177.672 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -63.27 -26.99 69.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.666 0.27 . . . . 73.329999999999998 111.087 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -66.53 -11.87 54.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.446 -0.343 . . . . 65.219999999999999 111.856 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.48 -28.01 66.78 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.274 -0.965 . . . . 75.430000000000007 111.233 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.9 m -64.17 -15.83 60.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.474 0.31 . . . . 73.540000000000006 111.657 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.9 t -119.15 22.19 11.95 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.153 0.501 . . . . 72.140000000000001 110.698 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.1 t -84.59 -60.88 1.93 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.45 -0.341 . . . . 74.329999999999998 110.814 178.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.536 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.8 m-85 -146.48 -175.29 4.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.814 0.34 . . . . 75.319999999999993 111.387 -177.035 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -102.1 -33.13 9.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.575 -0.739 . . . . 61.030000000000001 111.241 -174.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 p -113.01 153.02 28.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.897 -0.592 . . . . 73.010000000000005 110.804 -178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -67.37 -34.04 76.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.403 -0.362 . . . . 64.099999999999994 110.755 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.23 -36.44 84.15 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.247 -0.433 . . . . 53.039999999999999 111.001 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.663 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 98.9 mt-30 -84.84 -40.16 17.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.448 -0.342 . . . . 62.350000000000001 110.468 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' HG12 ' B' ' 285' ' ' ILE . 19.4 ttt -64.4 -45.1 89.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.234 -0.439 . . . . 73.010000000000005 111.425 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.603 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.2 tt0 -64.25 -33.44 75.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 63.329999999999998 110.993 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.47 -17.84 62.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.238 -0.437 . . . . 74.329999999999998 110.898 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.663 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.3 mmmt -100.44 -2.3 33.62 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.262 -0.426 . . . . 54.219999999999999 109.904 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.594 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 27.2 ttpp -53.54 -51.77 61.84 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.239 -0.437 . . . . 41.409999999999997 111.31 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -80.41 -11.22 59.72 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.318 -0.553 . . . . 65.319999999999993 110.45 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -83.49 -27.78 29.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.312 -0.404 . . . . 74.209999999999994 110.012 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.594 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 19.0 ptp -88.9 -33.23 17.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.353 -0.981 . . . . 71.450000000000003 108.353 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 61.6 mtp -85.56 14.66 5.34 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 115.402 -0.817 . . . . 74.140000000000001 111.144 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -87.37 -39.57 15.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.182 0.515 . . . . 54.219999999999999 110.321 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.646 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 39.2 p90 -103.59 -9.89 18.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.098 -0.501 . . . . 73.420000000000002 111.758 -173.37 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.416 ' O ' ' HE1' ' B' ' 237' ' ' MET . 11.6 m-30 -56.74 -48.94 76.67 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.864 0.364 . . . . 63.439999999999998 110.902 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.869 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.24 -47.03 72.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.53 0.681 . . . . 74.409999999999997 110.101 176.459 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -82.93 34.49 0.45 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.017 -0.992 . . . . 73.150000000000006 110.975 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.682 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 2.1 mmp_? -107.76 -32.57 7.57 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.982 -0.449 . . . . 75.230000000000004 110.995 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.805 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -107.08 3.61 26.04 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.348 -0.541 . . . . 72.129999999999995 110.027 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.433 ' HB2' ' HG2' ' B' ' 270' ' ' MET . 82.2 tttt -63.96 -54.04 40.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.025 -0.534 . . . . 53.399999999999999 110.748 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -62.6 -24.79 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.906 -0.588 . . . . 63.539999999999999 111.499 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.613 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 64.1 mtm -90.89 -23.0 20.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.022 0.439 . . . . 73.120000000000005 110.456 -179.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.421 HD13 ' HE1' ' B' ' 270' ' ' MET . 6.2 tt -73.16 -38.65 66.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.755 -0.832 . . . . 72.099999999999994 108.755 176.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.439 ' N ' ' HE1' ' B' ' 266' ' ' MET . 26.8 t70 -60.32 -31.88 70.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.321 -0.854 . . . . 72.150000000000006 110.588 178.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.59 -14.29 60.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.602 -0.726 . . . . 62.100000000000001 111.621 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -97.44 -9.96 26.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.224 0.535 . . . . 71.129999999999995 110.641 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.45 -169.64 1.05 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.891 -0.595 . . . . 74.340000000000003 110.276 174.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.556 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 64.17 -11.03 0.13 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.876 1.065 . . . . 64.319999999999993 113.876 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -53.57 -62.64 1.52 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.735 0.302 . . . . 52.329999999999998 111.457 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -81.99 5.68 18.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.756 0.313 . . . . 72.510000000000005 111.019 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.595 HG21 ' HB2' ' B' ' 259' ' ' GLN . 51.6 mt -97.74 -59.7 3.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.42 -0.354 . . . . 73.530000000000001 111.258 -175.23 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.4 pt-20 -71.88 -18.49 62.04 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.567 -0.453 . . . . 73.439999999999998 110.884 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -97.37 1.39 49.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.278 -0.419 . . . . 64.239999999999995 110.481 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -63.01 -38.43 91.18 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.658 -0.497 . . . . 70.319999999999993 109.658 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 N--CA 1.465 0.276 0 CA-C-N 115.622 -0.717 . . . . 64.510000000000005 110.432 174.225 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 26.1 p-10 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 120.689 0.28 . . . . 73.25 110.458 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 204' ' ' GLU . . . . . 0.529 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . 42.3 tt0 -114.2 74.27 0.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.168 0.508 . . . . 54.100000000000001 110.545 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 68.55 19.95 8.53 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.095 -0.957 . . . . 71.120000000000005 109.54 173.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.514 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -151.53 167.04 29.29 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.291 -0.868 . . . . 74.430000000000007 111.325 -170.577 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.483 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -90.59 45.65 1.28 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.811 -0.631 . . . . 71.340000000000003 111.066 -179.154 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.529 ' CE2' ' HB3' ' B' ' 204' ' ' GLU . 69.3 m-85 -49.07 -49.54 41.05 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.357 -0.383 . . . . 62.350000000000001 111.476 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.44 -34.8 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.142 -0.481 . . . . 70.519999999999996 111.819 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 10.5 mmp_? -68.69 -59.27 3.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.462 -0.335 . . . . 62.25 110.223 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.77 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -61.92 -17.66 57.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.888 -0.597 . . . . 72.329999999999998 111.593 -176.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 212' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 24.3 m -60.43 -34.4 73.93 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.633 -0.712 . . . . 70.209999999999994 110.921 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.537 ' HB2' HD11 ' A' ' 17' ' ' LEU . 32.2 mt-10 -81.1 -25.42 36.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 61.140000000000001 110.18 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.77 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.7 mm? -66.52 -41.22 89.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.641 -0.708 . . . . 74.530000000000001 110.209 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 93.2 mt -73.99 -18.58 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.898 -0.592 . . . . 64.510000000000005 111.194 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 212' ' ' THR . 31.2 mmmt -62.47 -40.53 96.95 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.042 -0.411 . . . . 71.099999999999994 111.043 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.2 tm? -65.79 -34.78 78.96 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.391 -0.596 . . . . 71.519999999999996 109.391 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.14 93.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.885 -0.598 . . . . 74.420000000000002 110.36 -178.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.563 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 24.4 m-80 -60.84 -35.07 75.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.961 -0.563 . . . . 73.430000000000007 110.678 178.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.08 -28.69 63.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 75.219999999999999 111.663 -179.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -84.22 -22.66 30.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.403 0.621 . . . . 53.240000000000002 110.032 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 222' ' ' ASN . . . . . 0.478 ' HA ' HG21 ' B' ' 232' ' ' VAL . 64.9 t30 -75.84 -8.56 57.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.271 -0.877 . . . . 73.209999999999994 109.94 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.563 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 10.9 mm-40 -83.32 1.23 42.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.793 -0.64 . . . . 55.509999999999998 110.653 177.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.33 111.62 22.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.356 -0.383 . . . . 73.120000000000005 110.157 -178.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.0 t -65.59 -36.69 84.5 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.986 0.736 . . . . 74.439999999999998 112.986 -173.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.69 -9.94 59.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.091 0.404 . . . . 54.409999999999997 112.091 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.563 HG22 ' HB2' ' B' ' 231' ' ' GLU . 7.0 mt -101.15 145.06 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.541 -0.54 . . . . 43.310000000000002 109.541 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.75 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 38.0 mt-30 -78.55 150.45 32.83 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.958 -0.564 . . . . 75.329999999999998 109.726 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -35.92 72.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.912 0.387 . . . . 40.450000000000003 110.519 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.71 -16.5 76.14 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.791 -0.641 . . . . 64.150000000000006 113.355 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.75 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 9.3 mm-40 -76.87 -31.33 56.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 117.477 0.639 . . . . 72.209999999999994 110.103 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 232' ' ' VAL . . . . . 0.478 HG21 ' HA ' ' B' ' 222' ' ' ASN . 22.0 t -72.05 -31.51 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.699 0.761 . . . . 62.439999999999998 109.762 178.404 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.14 -29.47 66.4 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.521 -0.763 . . . . 73.349999999999994 109.665 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.39 -33.41 37.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.592 -0.731 . . . . 65.219999999999999 111.424 -177.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 10.5 p -66.53 -36.74 83.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.096 -0.335 . . . . 71.200000000000003 110.096 178.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.57 ' CD1' HD12 ' A' ' 14' ' ' LEU . 3.2 t80 -65.78 -38.06 87.99 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.381 -0.6 . . . . 71.040000000000006 109.381 174.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.805 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.2 tpt -61.4 -54.38 44.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.232 -0.894 . . . . 72.430000000000007 110.639 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.613 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 27.2 t-105 -64.01 -36.58 84.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.517 -0.765 . . . . 71.310000000000002 111.421 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -62.01 -43.46 98.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.658 0.266 . . . . 72.109999999999999 110.744 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.01 -37.94 89.2 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.481 -0.327 . . . . 71.420000000000002 110.446 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.551 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -57.91 -39.99 79.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.475 -0.33 . . . . 51.030000000000001 111.347 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -75.02 -43.14 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.306 0.574 . . . . 74.420000000000002 110.283 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.425 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.5 t80 -69.81 -30.25 67.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.497 -0.774 . . . . 71.5 110.895 -175.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -79.87 -38.52 32.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.045 -0.525 . . . . 73.430000000000007 111.082 -175.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.14 -18.52 48.2 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.97 -0.559 . . . . 64.140000000000001 111.834 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -54.79 -34.22 62.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.789 -0.641 . . . . 63.420000000000002 111.227 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.844 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 41.5 m-85 -67.5 -15.08 63.48 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 112.12 0.415 . . . . 75.349999999999994 112.12 -176.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 248' ' ' GLY . . . . . 0.639 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -55.99 -31.09 58.33 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.596 -0.812 . . . . 54.100000000000001 112.143 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 62.2 p -74.19 -14.23 60.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.722 0.296 . . . . 74.430000000000007 111.455 -177.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 34.0 p -98.21 -5.96 32.24 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.848 0.356 . . . . 63.210000000000001 111.119 -176.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 67.3 m -78.89 -41.97 28.38 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 116.137 -0.483 . . . . 73.409999999999997 111.647 -175.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.627 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 3.0 m-85 -147.06 176.61 9.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.235 0.457 . . . . 71.030000000000001 112.235 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -101.09 -46.6 5.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.36 -0.836 . . . . 75.549999999999997 111.611 -172.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 40.9 p -100.63 151.19 21.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.52 -0.309 . . . . 65.129999999999995 110.287 -177.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -63.29 -36.29 83.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.126 -0.488 . . . . 74.510000000000005 111.075 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.74 -29.36 69.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.027 -0.533 . . . . 73.040000000000006 111.075 -176.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.758 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 98.6 mt-30 -91.25 -45.04 8.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 70.340000000000003 110.159 177.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 16.8 ttt -60.5 -41.93 95.3 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.952 -0.567 . . . . 73.140000000000001 111.552 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.595 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.6 tt0 -64.48 -40.09 95.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.83 0.348 . . . . 74.129999999999995 111.329 -178.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.54 -4.78 24.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.174 0.512 . . . . 52.009999999999998 110.954 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.758 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 71.9 mmtt -108.35 4.85 24.93 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.059 -0.519 . . . . 71.219999999999999 110.61 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.594 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 2.6 ptpp? -60.18 -49.46 77.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.399 -0.52 . . . . 72.319999999999993 110.225 -177.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.569 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 7.2 tp-100 -86.02 -1.32 57.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.555 0.693 . . . . 72.340000000000003 110.074 -179.211 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 264' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' B' ' 261' ' ' LYS . 4.1 tp10 -79.74 -43.44 22.59 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.821 -0.627 . . . . 74.219999999999999 109.324 173.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.639 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 3.8 ptt? -86.37 -31.62 21.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.941 0.4 . . . . 74.140000000000001 110.204 177.462 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.44 ' HB2' ' HA ' ' B' ' 263' ' ' GLN . 60.6 mtp -77.31 7.84 4.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.403 -0.362 . . . . 64.519999999999996 110.952 177.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -78.79 -42.6 27.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.095 0.474 . . . . 61.219999999999999 110.067 176.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.9 p90 -107.65 -12.93 15.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 73.319999999999993 111.751 -172.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 -51.88 -51.6 55.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.791 0.329 . . . . 74.310000000000002 111.199 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.869 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.87 -49.04 78.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.365 0.603 . . . . 72.219999999999999 110.228 177.316 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -87.27 42.02 1.01 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.207 -0.906 . . . . 61.329999999999998 110.647 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -104.61 -42.3 5.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.419 -0.355 . . . . 60.43 110.455 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.731 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -93.32 9.65 35.4 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.503 -0.479 . . . . 65.200000000000003 110.769 -175.531 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -63.93 -48.75 75.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.929 0.395 . . . . 60.439999999999998 110.426 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -67.66 -25.88 65.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.448 0.642 . . . . 75.030000000000001 110.737 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 276' ' ' MET . . . . . 0.631 ' HB3' ' HE3' ' A' ' 38' ' ' TRP . 56.0 mmm -83.45 -28.12 29.01 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.265 -0.88 . . . . 74.019999999999996 109.792 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.549 ' HA ' ' HB1' ' A' ' 41' ' ' ALA . 1.9 tt -72.62 -41.74 65.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.353 -0.84 . . . . 64.120000000000005 108.946 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -61.01 -31.43 71.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.504 -0.771 . . . . 73.310000000000002 110.123 176.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -71.94 -7.52 49.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.265 -0.88 . . . . 75.209999999999994 111.848 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -114.35 -8.22 12.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.95 0.405 . . . . 74.430000000000007 110.96 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.511 ' C ' ' H ' ' B' ' 283' ' ' ASP . 39.9 mtt -87.85 -162.77 0.85 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.269 -0.423 . . . . 73.129999999999995 110.248 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 5.0 mm-40 65.43 -22.9 0.09 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.79 0.836 . . . . 74.25 112.75 -176.541 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 283' ' ' ASP . . . . . 0.511 ' H ' ' C ' ' B' ' 281' ' ' MET . 20.6 t70 -48.03 -63.48 1.06 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.322 0.649 . . . . 71.319999999999993 111.883 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -68.0 -32.15 72.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.029 0.442 . . . . 54.43 110.813 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.603 HG21 ' HB2' ' A' ' 59' ' ' GLN . 46.0 mt -65.25 -56.96 12.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.666 -0.697 . . . . 75.230000000000004 111.52 -173.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 13.4 pt-20 -65.72 -21.01 66.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.848 0.356 . . . . 74.200000000000003 110.906 -177.702 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -102.1 9.18 40.47 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 74.329999999999998 112.272 -177.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -58.38 -52.94 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.53 -0.468 . . . . 72.129999999999995 110.325 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 52.329999999999998 110.954 178.246 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.9 p-10 . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 109.29 -0.633 . . . . 62.420000000000002 109.29 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -63.8 -57.59 9.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.613 -0.721 . . . . 74.120000000000005 110.517 -178.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -136.96 -56.61 0.72 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.987 0.423 . . . . 74.420000000000002 109.998 175.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -68.25 167.1 15.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.78 -0.646 . . . . 60.329999999999998 111.652 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.406 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -79.1 49.56 0.96 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.219 -0.9 . . . . 72.340000000000003 111.845 -178.127 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.411 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 54.2 m-85 -53.31 -42.42 66.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 73.400000000000006 110.972 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.4 -9.38 47.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.68 -0.691 . . . . 74.439999999999998 112.222 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.509 ' HE ' ' HA ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -98.54 -62.21 1.27 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.745 -0.465 . . . . 74.209999999999994 109.745 178.598 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.721 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.24 -23.88 24.8 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.743 0.646 . . . . 73.439999999999998 112.743 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.7 t -66.43 -24.92 66.53 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.738 0.304 . . . . 72.400000000000006 110.887 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.59 ' HB2' HD11 ' B' ' 217' ' ' LEU . 31.2 mt-10 -80.75 -31.17 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.481 0.658 . . . . 63.210000000000001 109.528 -177.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -67.16 -48.73 67.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.03 -0.986 . . . . 75.019999999999996 110.144 -178.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.451 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.0 mt -65.82 -29.11 45.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 74.400000000000006 110.53 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -25.88 65.37 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.98 -0.555 . . . . 71.430000000000007 110.681 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.564 HD12 HD13 ' B' ' 214' ' ' LEU . 2.4 tm? -75.42 -45.94 35.76 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.86 -0.792 . . . . 45.520000000000003 108.86 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.45 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -59.87 -37.54 79.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.519 0.676 . . . . 73.209999999999994 109.692 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 7.7 t-20 -56.58 -30.39 63.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.775 -1.102 . . . . 51.140000000000001 110.529 177.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -78.24 -35.07 48.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.772 . . . . 73.340000000000003 110.992 -176.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -79.2 -23.33 43.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.196 -0.456 . . . . 72.219999999999999 110.999 -176.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -86.89 7.51 26.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.238 0.542 . . . . 72.430000000000007 110.499 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 87.0 mm-40 -79.3 8.24 6.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 72.420000000000002 111.184 177.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.745 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.3 t-20 -101.94 111.9 24.33 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.426 -0.583 . . . . 73.129999999999995 109.426 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.6 t -56.03 -33.51 64.99 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.382 -0.826 . . . . 65.450000000000003 112.626 -175.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -95.68 13.79 25.23 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.438 0.533 . . . . 75.140000000000001 112.438 -173.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.745 HG13 ' HB3' ' A' ' 24' ' ' ASN . 5.7 mt -111.78 150.25 14.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.542 -0.54 . . . . 74.140000000000001 109.542 172.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.858 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 42.6 mt-30 -72.47 144.26 48.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.958 -0.564 . . . . 74.25 109.976 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 m -63.66 -26.32 68.61 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.228 -0.656 . . . . 61.119999999999997 109.228 175.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.47 ' HA2' ' OG ' ' A' ' 33' ' ' SER . . . -78.65 -8.03 87.87 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.195 -0.912 . . . . 63.100000000000001 113.122 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.858 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 12.6 mm-40 -78.64 -25.72 45.04 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.437 0.619 . . . . 72.530000000000001 109.859 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.45 HG11 ' O ' ' A' ' 18' ' ' ALA . 16.2 t -93.46 -31.49 4.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.353 -0.84 . . . . 70.439999999999998 110.762 -176.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.47 ' OG ' ' HA2' ' A' ' 30' ' ' GLY . 10.2 p -66.71 -37.15 84.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.245 0.545 . . . . 64.239999999999995 109.844 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.9 65.05 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.474 -0.785 . . . . 73.439999999999998 111.446 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.51 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 20.1 p -70.54 -31.79 68.97 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.905 0.383 . . . . 53.409999999999997 110.187 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.591 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.9 t80 -68.81 -41.35 78.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.879 -0.6 . . . . 72.209999999999994 109.456 174.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.752 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.1 ttm -64.06 -47.42 80.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.549 -0.75 . . . . 75.319999999999993 111.158 177.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.7 t-105 -61.31 -37.43 83.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.067 0.46 . . . . 75.439999999999998 110.751 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.572 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -68.93 -34.13 74.87 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.277 -0.42 . . . . 63.399999999999999 111.199 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.608 HD21 ' SD ' ' B' ' 237' ' ' MET . 48.8 tp -68.9 -35.94 77.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.017 0.437 . . . . 74.400000000000006 110.222 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.03 -42.87 99.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.869 -0.605 . . . . 53.219999999999999 110.72 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.409 ' NH2' HD12 ' B' ' 215' ' ' ILE . 47.7 mtm180 -71.94 -19.98 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 71.230000000000004 111.036 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -89.18 -42.13 11.84 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.307 -0.406 . . . . 63.009999999999998 110.462 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -69.71 -23.54 63.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 71.109999999999999 111.568 -179.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.37 61.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.144 0.497 . . . . 73.239999999999995 111.477 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -68.63 -31.46 70.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.025 -0.534 . . . . 71.430000000000007 110.881 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.453 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 91.1 m-85 -79.01 2.37 20.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.187 -0.461 . . . . 73.439999999999998 112.049 -173.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.445 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -59.03 -34.51 79.48 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.486 -0.864 . . . . 72.230000000000004 112.101 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.7 p -74.36 -14.83 60.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.765 0.317 . . . . 52.310000000000002 111.597 -177.148 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -88.5 -4.04 58.69 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.734 -0.386 . . . . 54.43 110.713 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.0 t -84.82 -36.97 21.28 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.371 -0.377 . . . . 74.140000000000001 110.756 -176.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -151.5 178.2 9.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.98 0.419 . . . . 75.409999999999997 111.311 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.407 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.5 pt-20 -99.43 -50.11 4.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.581 -0.736 . . . . 75.109999999999999 110.985 -176.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.407 HG23 ' HG3' ' A' ' 53' ' ' GLU . 63.0 p -92.25 150.52 20.83 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.156 -0.475 . . . . 74.129999999999995 110.323 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.426 ' HB2' ' HE2' ' A' ' 55' ' ' LYS . 11.2 ptmm? -68.09 -27.98 66.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.714 -0.394 . . . . 73.310000000000002 110.142 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.401 ' H ' ' CD ' ' A' ' 56' ' ' GLU . 1.7 mp0 -56.15 -54.84 40.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 73.319999999999993 110.465 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 90.0 mt-30 -77.38 -34.43 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.824 -0.625 . . . . 62.340000000000003 110.31 -177.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.421 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 20.4 ttt -63.68 -44.61 93.19 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.467 -0.788 . . . . 63.420000000000002 111.079 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.507 ' O ' ' HD2' ' A' ' 62' ' ' LYS . 35.6 tt0 -68.47 -28.6 67.18 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 73.340000000000003 111.234 -176.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.6 -6.68 51.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.494 -0.321 . . . . 44.530000000000001 111.801 -177.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.561 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 11.3 mmmm -112.83 10.06 19.06 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.683 -0.488 . . . . 72.409999999999997 109.683 -176.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HD2' ' O ' ' A' ' 59' ' ' GLN . 9.6 ptmt -51.27 -41.16 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.379 -0.828 . . . . 65.129999999999995 111.421 -177.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -87.76 -30.39 20.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.512 0.196 . . . . 74.109999999999999 110.622 -175.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.08 -37.17 86.14 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 116.377 -0.374 . . . . 71.030000000000001 111.302 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.451 ' HA ' ' CE2' ' A' ' 68' ' ' TYR . 23.2 ptp -83.27 -31.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.77 -0.826 . . . . 73.150000000000006 108.77 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.529 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 21.3 mtp -86.63 33.86 0.65 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.306 -0.861 . . . . 73.439999999999998 112.456 -176.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -129.13 -46.27 1.23 Allowed 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.165 -0.614 . . . . 74.430000000000007 109.949 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.451 ' CE2' ' HA ' ' A' ' 65' ' ' MET . 16.3 p90 -72.42 -17.07 61.83 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.742 -0.383 . . . . 71.230000000000004 110.028 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.724 ' HA ' ' HD3' ' A' ' 72' ' ' ARG . 6.2 m-30 -58.21 -50.5 73.33 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.766 -0.457 . . . . 74.530000000000001 109.766 174.169 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.65 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.36 -47.11 79.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.669 0.747 . . . . 71.329999999999998 109.467 174.444 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -80.0 31.42 0.26 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.58 -1.191 . . . . 73.129999999999995 111.437 -176.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.724 ' HD3' ' HA ' ' A' ' 69' ' ' TYR . 4.8 mtp180 -103.19 -29.75 11.11 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.662 -0.649 . . . . 72.319999999999993 111.452 -176.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.914 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -115.95 14.65 16.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.325 -0.55 . . . . 74.239999999999995 111.493 -177.746 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -63.34 -50.83 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.457 -0.572 . . . . 74.230000000000004 109.457 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.9 -30.79 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.841 -0.618 . . . . 73.420000000000002 111.272 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.4 mtt -69.46 -41.25 76.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.235 0.54 . . . . 72.329999999999998 109.571 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tt -68.92 -31.78 70.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.99 -1.005 . . . . 74.409999999999997 109.095 -179.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.569 ' N ' ' HE1' ' B' ' 266' ' ' MET . 16.1 t70 -61.86 -34.4 75.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.112 -0.949 . . . . 73.230000000000004 110.912 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.05 -4.2 46.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 52.219999999999999 111.1 -178.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.23 -31.18 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.099 0.476 . . . . 74.400000000000006 109.85 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.584 ' HG3' ' SD ' ' B' ' 266' ' ' MET . 25.0 mmt -68.82 176.32 3.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.457 -0.792 . . . . 74.319999999999993 110.663 174.525 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.587 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 9.6 mm-40 65.29 -30.6 0.13 Allowed 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.331 1.053 . . . . 73.420000000000002 113.19 -177.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 81' ' ' MET . 22.7 t70 -57.76 -64.02 1.04 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.9 0.381 . . . . 73.319999999999993 110.851 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -68.15 -14.66 63.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.379 . . . . 71.319999999999993 110.953 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.587 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 63.3 mt -81.49 -57.71 4.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 65.420000000000002 111.025 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.5 pt-20 -58.48 -34.68 71.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.931 0.396 . . . . 72.230000000000004 110.428 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.427 ' N ' ' HG3' ' A' ' 86' ' ' GLU . 50.6 m-80 -88.11 -0.55 57.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.049 -0.523 . . . . 74.430000000000007 111.462 -177.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.472 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 83.9 t80 -61.34 -43.51 98.75 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 120.4 -0.52 . . . . 63.340000000000003 109.863 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 64.219999999999999 110.238 176.87 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.544 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.2 p-10 . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 121.13 0.491 . . . . 72.540000000000006 111.114 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -81.39 -90.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.805 -0.634 . . . . 72.420000000000002 111.365 -175.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -102.53 -36.83 8.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.285 0.564 . . . . 54.450000000000003 109.846 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.544 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -97.82 150.75 20.93 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.473 -0.785 . . . . 74.409999999999997 110.74 176.263 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.51 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -75.85 54.77 0.84 Allowed 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.659 -1.155 . . . . 63.350000000000001 112.121 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -52.8 -43.39 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.414 -0.357 . . . . 74.209999999999994 111.094 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -68.03 -10.77 56.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.824 -0.625 . . . . 70.549999999999997 112.086 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.561 ' HE ' ' HA ' ' B' ' 210' ' ' ARG . 1.1 mmp_? -96.13 -60.83 1.55 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.921 -0.4 . . . . 70.530000000000001 109.921 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.719 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.24 -20.6 28.4 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.807 0.669 . . . . 65.409999999999997 112.807 -176.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.26 -24.54 65.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.794 0.33 . . . . 71.230000000000004 111.038 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.475 ' HB2' HD11 ' A' ' 17' ' ' LEU . 41.8 mt-10 -87.34 -24.04 24.41 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.13 0.491 . . . . 75.319999999999993 109.962 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.719 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.8 mm? -68.88 -49.1 61.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.538 -0.755 . . . . 63.420000000000002 110.334 -178.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.572 HG13 ' HB1' ' A' ' 39' ' ' ALA . 65.2 mt -68.86 -25.23 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.01 0.433 . . . . 74.409999999999997 110.385 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.512 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.9 OUTLIER -59.0 -36.07 74.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.048 -0.524 . . . . 53.439999999999998 110.439 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.3 tm? -65.89 -43.55 87.95 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.096 -0.705 . . . . 74.030000000000001 109.096 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.09 66.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 74.439999999999998 110.678 178.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 12.6 m120 -62.09 -35.09 77.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.008 -0.542 . . . . 75.329999999999998 110.247 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -74.33 -24.96 59.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.195 -0.457 . . . . 65.400000000000006 111.216 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 221' ' ' GLN . . . . . 0.428 ' HB2' HG13 ' B' ' 232' ' ' VAL . 62.7 mt-30 -86.85 -27.43 23.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.994 0.426 . . . . 72.340000000000003 110.33 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -81.17 -1.88 46.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.859 -0.61 . . . . 71.519999999999996 110.744 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.8 mm-40 -69.96 -17.52 63.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.108 0.48 . . . . 74.219999999999999 110.388 176.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.425 ' HB3' HG13 ' B' ' 227' ' ' ILE . 0.9 OUTLIER -79.6 124.53 28.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.965 -0.561 . . . . 73.340000000000003 110.109 176.101 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.7 t -99.86 -17.32 17.69 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.09 -0.505 . . . . 71.409999999999997 110.232 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -80.64 -6.42 58.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 75.540000000000006 110.932 176.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.425 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.2 mt -111.96 153.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.467 -0.568 . . . . 74.030000000000001 109.467 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.19 142.21 49.05 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.064 -0.347 . . . . 45.539999999999999 110.064 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.1 m -62.22 -24.08 67.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.523 0.678 . . . . 75.430000000000007 109.981 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 230' ' ' GLY . . . . . 0.453 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.32 -32.16 83.28 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.383 -0.826 . . . . 25.0 112.676 178.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -65.09 -32.54 74.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.889 0.376 . . . . 75.430000000000007 110.673 -177.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 232' ' ' VAL . . . . . 0.428 HG13 ' HB2' ' B' ' 221' ' ' GLN . 11.8 t -75.09 -29.27 21.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 74.140000000000001 110.657 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 72.3 p -74.63 -24.96 58.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.437 0.637 . . . . 63.299999999999997 109.493 175.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.81 -33.91 34.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.446 -0.797 . . . . 64.219999999999999 110.906 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 5.3 p -67.61 -36.63 81.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 120.898 0.38 . . . . 65.140000000000001 110.071 177.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.589 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 2.1 t80 -68.39 -36.01 78.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 74.230000000000004 109.406 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.914 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.3 tpt -63.31 -56.41 16.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.251 -0.886 . . . . 62.25 110.527 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.3 t-105 -60.53 -35.61 76.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.206 -0.906 . . . . 72.200000000000003 111.103 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.42 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.99 -43.22 88.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.418 -0.355 . . . . 74.299999999999997 111.338 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.18 -34.81 78.45 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.733 0.301 . . . . 70.409999999999997 110.489 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.9 79.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 73.219999999999999 111.102 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 242' ' ' ARG . . . . . 0.422 HH21 HD12 ' A' ' 15' ' ' ILE . 28.6 mtm180 -70.45 -27.81 64.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 75.040000000000006 111.125 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.451 ' HD2' HG23 ' A' ' 15' ' ' ILE . 8.8 t80 -80.86 -34.86 33.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 72.299999999999997 110.349 -178.344 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -75.95 -35.82 59.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.029 -0.532 . . . . 71.099999999999994 110.852 -176.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.37 -22.69 63.59 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.967 -0.561 . . . . 73.340000000000003 111.798 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.5 t90 -55.19 -33.86 63.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.99 -0.55 . . . . 75.319999999999993 111.443 179.147 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -74.58 -7.46 53.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 75.340000000000003 111.975 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -65.14 -34.59 90.08 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.271 -0.966 . . . . 74.310000000000002 111.491 176.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.2 m -71.22 -9.69 58.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.76 0.314 . . . . 70.340000000000003 111.681 -177.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.4 t -119.74 16.77 12.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 74.530000000000001 110.388 178.467 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.6 t -90.22 -27.45 19.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.054 0.454 . . . . 72.0 109.941 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 252' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -146.06 170.41 16.71 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.222 -0.659 . . . . 73.420000000000002 109.222 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.553 ' HG3' HG23 ' B' ' 254' ' ' THR . 10.1 pt-20 -89.41 -37.38 14.87 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.787 -0.365 . . . . 64.530000000000001 111.557 -175.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.553 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.7 p -110.94 159.75 17.43 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 123.166 0.292 . . . . 63.009999999999998 110.535 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.614 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 12.0 ptmm? -74.79 -26.14 59.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.847 -0.427 . . . . 72.439999999999998 109.847 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -54.47 -42.7 70.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 72.430000000000007 110.619 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' B' ' 261' ' ' LYS . 86.3 mt-30 -91.48 -37.12 13.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.763 -0.653 . . . . 70.450000000000003 110.394 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.614 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 17.9 ttt -60.56 -40.85 93.14 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.078 -0.51 . . . . 63.409999999999997 111.712 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.472 ' HB2' HG21 ' A' ' 85' ' ' ILE . 31.5 tt0 -72.33 -31.17 65.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.067 -0.515 . . . . 73.310000000000002 111.844 -174.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -79.31 -13.42 59.66 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.266 0.555 . . . . 61.020000000000003 110.984 -167.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.577 ' HD3' ' C ' ' B' ' 261' ' ' LYS . 0.0 OUTLIER -126.78 26.37 6.22 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 115.67 -0.695 . . . . 74.530000000000001 112.138 -175.512 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.651 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 0.0 OUTLIER -59.17 -35.0 72.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 109.907 175.886 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.408 ' N ' ' HG2' ' B' ' 262' ' ' LYS . 5.2 tp-100 -73.09 -25.56 60.93 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.329 -0.396 . . . . 74.430000000000007 111.434 -176.31 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 264' ' ' GLU . . . . . 0.45 ' OE1' ' HB2' ' B' ' 261' ' ' LYS . 40.5 mt-10 -57.47 -55.16 38.37 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.219 0.533 . . . . 73.230000000000004 110.309 176.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.705 ' HA ' ' CE2' ' B' ' 268' ' ' TYR . 2.2 ptt? -72.33 -34.79 68.32 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.955 -0.566 . . . . 74.219999999999999 109.909 -177.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.584 ' SD ' ' HG3' ' A' ' 81' ' ' MET . 26.5 mtp -79.98 19.36 0.71 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.923 -0.581 . . . . 74.519999999999996 111.639 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.98 -44.06 3.06 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.574 -0.528 . . . . 73.329999999999998 109.574 175.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.705 ' CE2' ' HA ' ' B' ' 265' ' ' MET . 20.7 p90 -91.27 -19.41 23.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.016 -0.538 . . . . 73.530000000000001 111.561 -178.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.427 ' CE2' ' HB2' ' B' ' 265' ' ' MET . 1.6 m-30 -52.76 -48.17 66.96 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.825 0.345 . . . . 70.409999999999997 110.763 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.65 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -54.05 -47.97 71.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.598 -0.728 . . . . 53.329999999999998 111.217 178.353 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.66 26.88 2.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.376 -0.829 . . . . 72.209999999999994 111.765 -168.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 12.0 mtp180 -95.66 -26.86 15.56 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.485 -0.486 . . . . 64.319999999999993 111.626 -178.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.752 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.06 11.1 37.64 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.523 -0.471 . . . . 71.209999999999994 110.45 -178.841 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.431 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.6 ttmt -65.01 -43.35 92.79 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.119 -0.491 . . . . 71.209999999999994 110.403 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.43 -39.47 93.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.651 0.263 . . . . 45.350000000000001 111.418 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.5 mtt -61.31 -46.24 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.453 0.644 . . . . 70.310000000000002 109.727 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.444 ' CD2' ' HE2' ' B' ' 281' ' ' MET . 1.1 tt -67.58 -33.25 74.65 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.784 -1.098 . . . . 61.439999999999998 109.663 -178.51 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 278' ' ' ASP . . . . . 0.529 ' N ' ' HE1' ' A' ' 66' ' ' MET . 19.6 t70 -64.86 -28.38 69.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.253 -0.885 . . . . 74.430000000000007 110.425 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -90.33 -2.39 57.99 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.261 -0.881 . . . . 62.140000000000001 111.092 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -104.91 -23.76 12.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 72.109999999999999 110.507 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.444 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.3 mmt -69.31 179.18 2.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.537 0.684 . . . . 71.209999999999994 111.672 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.722 ' HA ' HD12 ' B' ' 285' ' ' ILE . 30.2 mt-10 68.63 -12.29 0.37 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.326 -1.306 . . . . 64.409999999999997 112.97 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.96 -58.93 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 72.209999999999994 110.395 177.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -72.65 -16.06 61.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.165 -0.471 . . . . 75.219999999999999 110.885 178.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.722 HD12 ' HA ' ' B' ' 282' ' ' GLU . 60.9 mt -77.54 -57.08 6.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.116 -0.493 . . . . 73.129999999999995 110.551 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.2 pt-20 -67.34 -25.26 65.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 52.240000000000002 110.809 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -94.99 15.75 17.99 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.179 -0.464 . . . . 74.200000000000003 111.519 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -58.12 -50.09 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.198 -0.667 . . . . 75.129999999999995 109.198 173.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.4 t70 . . . . . 0 N--CA 1.466 0.334 0 CA-C-N 115.667 -0.697 . . . . 71.420000000000002 111.33 175.112 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.753 ' ND2' ' HA ' ' A' ' 7' ' ' PHE . 89.1 m-20 . . . . . 0 CA--C 1.519 -0.249 0 CA-C-O 121.116 0.484 . . . . 75.439999999999998 111.208 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -97.31 -80.58 0.44 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.4 -0.963 . . . . 71.140000000000001 108.4 168.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -113.6 -47.63 2.98 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.897 -0.779 . . . . 72.450000000000003 108.897 170.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -82.82 159.49 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.408 -0.815 . . . . 64.319999999999993 111.835 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.753 ' HA ' ' ND2' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -75.82 56.36 0.94 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.87 -1.059 . . . . 65.099999999999994 112.309 179.272 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.451 ' HE1' ' HZ2' ' B' ' 238' ' ' TRP . 58.5 m-85 -56.2 -44.35 79.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.514 -0.312 . . . . 73.420000000000002 111.419 -179.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.61 61.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.339 -0.391 . . . . 70.329999999999998 111.627 -177.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -88.18 -65.23 1.04 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.397 -0.365 . . . . 72.120000000000005 110.099 177.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.693 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -58.64 -21.94 55.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 112.68 0.622 . . . . 72.010000000000005 112.68 -175.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.642 HG23 ' HG2' ' A' ' 13' ' ' GLU . 6.1 t -59.41 -28.91 67.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.136 0.494 . . . . 71.209999999999994 110.814 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.642 ' HG2' HG23 ' A' ' 12' ' ' THR . 5.4 mm-40 -92.31 -26.3 18.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.874 -0.603 . . . . 71.430000000000007 110.171 -173.72 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.693 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -64.51 -45.03 89.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.298 -0.864 . . . . 62.530000000000001 109.178 173.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.519 HG13 ' HB1' ' B' ' 239' ' ' ALA . 89.4 mt -69.24 -34.76 64.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.689 -0.687 . . . . 73.109999999999999 110.373 175.684 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -64.22 -30.83 71.87 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.849 -0.614 . . . . 64.019999999999996 111.351 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.59 HD12 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -65.04 -41.85 94.85 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.946 -0.761 . . . . 70.310000000000002 108.946 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.94 70.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.378 -0.828 . . . . 74.540000000000006 110.865 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -63.47 -26.36 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.817 -0.628 . . . . 64.209999999999994 110.978 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.417 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 2.7 mp0 -85.35 -8.61 58.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.207 -0.451 . . . . 75.430000000000007 111.194 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . 0.428 ' OE1' HD21 ' B' ' 214' ' ' LEU . 80.8 mt-30 -104.68 -29.27 10.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.82 0.343 . . . . 74.150000000000006 110.498 177.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -83.08 -12.47 57.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.037 0.446 . . . . 73.439999999999998 110.569 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.417 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.9 pt20 -73.45 -1.01 16.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.175 0.512 . . . . 70.5 110.326 175.587 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.607 ' HB3' HG13 ' A' ' 27' ' ' ILE . 0.8 OUTLIER -82.43 108.02 15.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.832 -0.803 . . . . 52.240000000000002 108.832 175.665 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.4 t -62.03 -25.61 67.76 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 113.028 0.751 . . . . 62.119999999999997 113.028 -171.477 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.3 0.88 55.64 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.986 0.365 . . . . 72.420000000000002 111.986 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.607 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.1 mt -113.31 147.78 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.476 -0.564 . . . . 71.400000000000006 109.476 176.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -88.5 157.95 18.48 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.837 -0.431 . . . . 71.129999999999995 109.837 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.4 m -65.73 -27.54 68.39 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.107 0.48 . . . . 54.420000000000002 110.012 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.19 -29.94 76.4 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.63 -0.714 . . . . 73.510000000000005 112.669 178.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -69.96 -30.98 68.47 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.468 0.651 . . . . 72.109999999999999 109.612 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.7 t -82.1 -32.89 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.189 -0.914 . . . . 54.420000000000002 110.771 -177.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.402 ' HB3' ' CE1' ' B' ' 247' ' ' PHE . 93.2 p -65.92 -28.77 69.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.315 0.579 . . . . 65.109999999999999 109.803 176.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.0 -32.44 26.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.608 -0.724 . . . . 65.409999999999997 111.216 -178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.437 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 15.1 p -70.51 -36.79 73.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.971 0.415 . . . . 71.549999999999997 109.968 -178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.709 ' HD1' HD12 ' B' ' 214' ' ' LEU . 17.2 t80 -64.93 -35.29 80.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.402 0.62 . . . . 74.310000000000002 109.713 175.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.61 ' CG ' ' HB3' ' B' ' 273' ' ' TYR . 13.2 ttm -73.27 -47.44 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.657 -0.701 . . . . 74.319999999999993 111.529 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 14.9 t-105 -60.03 -36.63 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.919 0.39 . . . . 74.310000000000002 110.352 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.49 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.64 -38.09 88.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 73.510000000000005 110.862 177.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.0 tp -66.35 -38.48 87.71 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 110.012 -0.366 . . . . 51.020000000000003 110.012 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.473 ' HB2' ' HB2' ' B' ' 273' ' ' TYR . . . -60.74 -28.23 68.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.34 -0.391 . . . . 74.439999999999998 111.155 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -86.12 -45.44 11.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.037 0.446 . . . . 73.329999999999998 110.665 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.46 ' HD2' HG23 ' B' ' 215' ' ' ILE . 24.5 t80 -70.22 -37.16 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.898 -0.592 . . . . 65.400000000000006 111.205 -175.678 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.7 -18.6 58.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.289 -0.414 . . . . 74.319999999999993 111.184 -174.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.565 ' HB2' HD23 ' B' ' 277' ' ' LEU . . . -78.68 -5.15 52.3 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.109 0.48 . . . . 71.420000000000002 110.968 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -57.41 -39.51 76.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.420000000000002 109.913 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.424 ' HA ' HG22 ' A' ' 50' ' ' THR . 92.8 m-85 -75.91 -9.08 58.31 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.903 -0.59 . . . . 62.149999999999999 111.38 -176.541 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.504 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.13 -38.32 92.14 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.624 -0.99 . . . . 55.310000000000002 110.624 172.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.7 m -71.74 -6.81 44.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.494 0.318 . . . . 74.310000000000002 111.581 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.424 HG22 ' HA ' ' A' ' 47' ' ' PHE . 6.1 t -117.44 10.98 13.75 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.209 0.528 . . . . 74.319999999999993 110.113 178.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.73 -44.24 15.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.954 -0.566 . . . . 53.310000000000002 110.236 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.562 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.1 m-85 -145.29 176.35 9.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.426 -0.352 . . . . 61.399999999999999 111.081 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.4 ' HG2' ' H ' ' A' ' 53' ' ' GLU . 7.9 pt-20 -97.77 -42.29 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.712 -0.676 . . . . 62.219999999999999 111.636 -173.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 63.8 p -102.57 152.41 21.19 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.746 -0.207 . . . . 65.340000000000003 110.509 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -65.85 -32.19 73.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.083 0.468 . . . . 71.439999999999998 110.17 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -52.62 -51.32 60.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.043 -0.981 . . . . 63.020000000000003 110.606 178.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.628 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 95.5 mt-30 -87.65 -32.92 19.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.525 -0.761 . . . . 61.149999999999999 111.064 -176.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 18.5 ttt -64.21 -42.43 96.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.894 0.378 . . . . 64.340000000000003 110.786 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.55 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 36.7 tt0 -65.67 -27.7 68.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 75.209999999999994 110.679 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.99 -8.45 57.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.358 -0.383 . . . . 71.109999999999999 110.778 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.628 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 29.4 mmmt -114.87 -6.62 12.62 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.35 -0.386 . . . . 71.209999999999994 111.319 -176.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.703 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 56.5 pttt -65.23 -44.7 87.36 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.614 -0.435 . . . . 65.120000000000005 110.956 -172.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.42 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 9.1 tp60 -74.96 -16.99 60.62 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.921 -0.4 . . . . 73.140000000000001 109.921 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -78.82 -38.59 37.76 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.375 -0.375 . . . . 72.129999999999995 110.765 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.703 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 18.4 ptp -80.65 -27.92 37.02 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.633 -0.877 . . . . 71.349999999999994 108.633 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.423 ' CE ' ' HB3' ' B' ' 277' ' ' LEU . 45.5 mtp -90.45 9.6 28.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.994 -1.003 . . . . 64.299999999999997 111.248 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -81.36 -37.15 28.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.401 -0.592 . . . . 74.120000000000005 109.401 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.527 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 48.3 p90 -106.83 -10.1 16.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.607 -0.724 . . . . 63.340000000000003 111.327 -175.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.431 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 2.3 m-30 -55.55 -51.35 67.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.714 0.292 . . . . 74.329999999999998 110.992 -178.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.886 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.83 -41.27 77.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.704 0.764 . . . . 74.329999999999998 110.008 175.854 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -80.71 3.74 21.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.417 -1.265 . . . . 73.239999999999995 112.443 -169.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.692 ' HB2' ' SD ' ' B' ' 237' ' ' MET . 48.0 mtm180 -82.76 -41.53 19.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 121.653 -0.654 . . . . 73.329999999999998 110.621 -173.072 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.832 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -94.12 9.83 36.21 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.285 0.564 . . . . 64.109999999999999 109.924 -176.08 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.222 -0.899 . . . . 64.010000000000005 110.003 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -68.93 -30.26 68.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 75.5 110.844 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.411 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 57.1 mtt -68.26 -38.54 81.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.378 0.609 . . . . 75.5 110.064 176.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.598 ' HB3' ' HE3' ' B' ' 266' ' ' MET . 0.5 OUTLIER -72.14 -44.85 62.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.125 -0.943 . . . . 73.510000000000005 110.63 -176.531 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.63 -41.21 80.92 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.314 0.578 . . . . 61.219999999999999 110.213 -178.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.87 -20.12 65.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.078 -0.965 . . . . 71.299999999999997 111.753 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.682 ' OD1' ' HD2' ' B' ' 242' ' ' ARG . 0.8 OUTLIER -92.83 -30.35 15.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.781 0.324 . . . . 72.340000000000003 110.868 179.721 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.593 ' HE2' ' HA ' ' B' ' 245' ' ' ALA . 21.6 mmt -61.89 -61.96 2.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.776 -0.647 . . . . 74.340000000000003 111.226 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.58 ' HA ' HD12 ' A' ' 85' ' ' ILE . 7.4 pt-20 -70.22 -13.08 62.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.721 -0.672 . . . . 72.430000000000007 112.771 -171.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.1 -51.96 66.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.374 . . . . 64.319999999999993 110.303 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -64.95 -36.51 84.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.128 0.49 . . . . 73.329999999999998 110.0 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.888 HD13 ' HA ' ' B' ' 259' ' ' GLN . 79.3 mt -63.69 -57.16 12.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.382 -0.826 . . . . 72.519999999999996 112.136 -176.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.8 pt-20 -61.72 -32.48 72.71 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.037 -0.265 . . . . 63.450000000000003 111.084 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -93.2 5.24 52.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.342 -0.39 . . . . 65.150000000000006 111.592 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.541 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 63.7 t80 -57.36 -49.88 74.74 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 121.481 -0.088 . . . . 72.0 111.225 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.445 ' OD2' ' HD3' ' B' ' 255' ' ' LYS . 72.1 m-20 . . . . . 0 CA--C 1.519 -0.228 0 CA-C-O 120.985 0.421 . . . . 73.209999999999994 110.45 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.769 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 94.7 m-20 . . . . . 0 CA--C 1.519 -0.242 0 N-CA-C 110.281 -0.266 . . . . 75.120000000000005 110.281 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 204' ' ' GLU . . . . . 0.447 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 13.6 tp10 -132.43 -77.37 0.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.092 -0.504 . . . . 75.340000000000003 110.239 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -98.92 -21.74 16.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.402 0.62 . . . . 74.549999999999997 109.769 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.469 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -148.72 168.66 22.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.565 -0.743 . . . . 74.540000000000006 112.043 -174.082 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.769 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -70.87 53.81 0.16 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.488 -1.233 . . . . 73.239999999999995 112.429 178.295 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.447 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 29.3 m-85 -56.24 -47.4 78.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.611 -0.268 . . . . 72.430000000000007 111.136 -178.705 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.94 -16.05 63.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 63.0 111.735 -176.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.681 ' HE ' ' HA ' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -88.12 -63.59 1.28 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.44 -0.345 . . . . 53.119999999999997 110.16 177.673 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.624 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -53.67 -29.65 39.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.905 0.705 . . . . 72.120000000000005 112.905 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 212' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 7.1 t -64.68 -25.01 67.76 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.675 0.274 . . . . 45.100000000000001 111.073 -177.132 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -82.3 -24.3 34.73 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.251 0.548 . . . . 73.209999999999994 109.622 -178.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.709 HD12 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -68.9 -42.63 76.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.347 -0.842 . . . . 70.510000000000005 109.279 177.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.49 HG13 ' HB1' ' A' ' 39' ' ' ALA . 87.8 mt -68.91 -28.48 39.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.423 -0.808 . . . . 72.120000000000005 110.255 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' B' ' 212' ' ' THR . 28.4 mmmt -57.27 -47.26 81.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.349 -0.387 . . . . 64.230000000000004 111.503 178.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.509 HD13 ' O ' ' B' ' 217' ' ' LEU . 1.9 tm? -61.59 -32.17 72.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.5 -0.556 . . . . 74.120000000000005 109.5 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -68.8 -32.98 73.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.819 -0.628 . . . . 54.539999999999999 110.821 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -66.56 -31.05 71.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.877 0.37 . . . . 71.219999999999999 110.783 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.66 -4.81 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.08 -0.509 . . . . 64.109999999999999 111.175 -178.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -110.17 -17.86 13.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.529 0.68 . . . . 72.439999999999998 109.295 172.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -78.96 -21.54 47.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.871 -1.058 . . . . 75.420000000000002 110.196 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.17 12.37 0.74 Allowed 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.671 -0.695 . . . . 73.340000000000003 111.975 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.501 ' HB3' HG13 ' B' ' 227' ' ' ILE . 0.7 OUTLIER -98.31 109.35 22.12 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 44.32 109.72 179.599 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 225' ' ' THR . . . . . 0.4 ' H ' HG22 ' B' ' 225' ' ' THR . 2.7 t -65.46 -28.89 69.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.488 0.551 . . . . 61.439999999999998 112.488 -173.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -87.91 4.58 44.23 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.915 0.339 . . . . 61.200000000000003 111.915 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.501 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.1 mt -117.86 161.66 16.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.149 -0.686 . . . . 52.219999999999999 109.149 174.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -105.29 152.23 23.16 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.477 -0.564 . . . . 74.530000000000001 109.477 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.0 m -55.83 -28.28 55.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.03 0.443 . . . . 72.150000000000006 110.687 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -64.11 -22.67 67.18 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.705 -0.679 . . . . 75.430000000000007 113.22 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -83.84 -17.13 41.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.232 0.539 . . . . 50.310000000000002 110.018 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 15.2 t -90.2 -39.52 12.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 72.420000000000002 109.854 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 33.5 p -65.8 -34.36 77.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.21 0.529 . . . . 63.340000000000003 109.841 175.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -72.03 -34.33 68.72 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.571 -0.741 . . . . 33.240000000000002 111.325 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.467 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 4.0 p -75.82 -32.64 59.92 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.986 -0.376 . . . . 34.329999999999998 109.986 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.47 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.9 t80 -64.96 -39.73 93.94 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.001 -0.74 . . . . 74.239999999999995 109.001 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.832 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 1.2 ttm -66.65 -48.3 69.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.395 -0.82 . . . . 62.140000000000001 111.226 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.451 ' HZ2' ' HE1' ' A' ' 8' ' ' TYR . 19.2 t-105 -60.62 -44.46 96.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.395 -0.366 . . . . 72.019999999999996 110.758 177.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.533 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -61.95 -36.26 80.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.412 . . . . 74.420000000000002 111.057 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.52 -40.56 97.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.378 -0.374 . . . . 71.099999999999994 110.278 177.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.584 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.77 -45.1 94.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.065 0.46 . . . . 72.450000000000003 110.344 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 242' ' ' ARG . . . . . 0.682 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 11.1 mmm180 -58.87 -41.28 86.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 63.310000000000002 110.755 178.095 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 243' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' B' ' 246' ' ' TRP . 10.5 t80 -75.92 -38.22 57.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 64.040000000000006 111.028 -175.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -69.55 -31.78 70.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.887 0.328 . . . . 64.409999999999997 111.887 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.593 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -72.32 -17.64 61.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 65.030000000000001 111.266 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 246' ' ' TRP . . . . . 0.404 ' HB3' ' O ' ' B' ' 243' ' ' TYR . 12.6 t90 -64.64 -23.69 67.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.614 -0.721 . . . . 74.200000000000003 109.68 175.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 247' ' ' PHE . . . . . 0.429 ' O ' HG22 ' B' ' 250' ' ' THR . 69.1 m-85 -85.47 2.89 42.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.095 -0.502 . . . . 74.239999999999995 111.39 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.87 92.44 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.237 -0.982 . . . . 61.509999999999998 111.445 175.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.0 m -62.33 -24.57 67.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.681 0.277 . . . . 71.540000000000006 111.658 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 250' ' ' THR . . . . . 0.429 HG22 ' O ' ' B' ' 247' ' ' PHE . 14.6 t -98.27 10.7 40.05 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.606 -0.438 . . . . 44.140000000000001 110.738 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 33.7 t -87.93 -54.58 4.16 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.966 -0.383 . . . . 61.219999999999999 109.966 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.643 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 2.0 m-85 -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.165 0.507 . . . . 72.540000000000006 111.736 178.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.54 ' HG3' HG23 ' B' ' 254' ' ' THR . 8.9 pt-20 -95.45 -47.22 6.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.12 -0.946 . . . . 71.310000000000002 111.628 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.54 HG23 ' HG3' ' B' ' 253' ' ' GLU . 65.2 p -102.67 161.85 13.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.572 -0.285 . . . . 71.420000000000002 110.501 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.8 ptmt -72.38 -29.8 64.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.877 -0.329 . . . . 73.400000000000006 110.503 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -61.05 -41.7 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.938 -0.574 . . . . 50.329999999999998 110.574 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.616 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 97.3 mt-30 -86.81 -39.75 15.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.922 -0.581 . . . . 74.519999999999996 110.809 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.3 ttt -63.81 -35.8 81.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.404 -0.362 . . . . 73.109999999999999 111.194 -178.025 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.888 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.9 tt0 -62.52 -40.85 98.08 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.934 0.397 . . . . 74.230000000000004 111.073 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -71.35 -9.12 57.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.836 -0.62 . . . . 64.140000000000001 111.183 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.643 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 31.5 mmmt -107.99 -3.44 18.79 Favored 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 111.947 0.351 . . . . 53.210000000000001 111.947 -173.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 262' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 50.9 pttt -59.51 -49.73 76.65 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.217 -0.593 . . . . 74.319999999999993 110.401 -177.133 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 263' ' ' GLN . . . . . 0.504 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 17.8 tp60 -67.46 -23.19 65.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.873 0.368 . . . . 60.32 110.568 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -82.45 -34.24 28.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.192 -0.458 . . . . 73.439999999999998 111.535 -178.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 21.6 ptp -83.88 -25.34 30.31 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.883 -0.784 . . . . 71.420000000000002 108.883 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.598 ' HE3' ' HB3' ' A' ' 77' ' ' LEU . 56.1 mtp -85.83 -12.33 51.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.096 -0.956 . . . . 74.209999999999994 110.664 177.351 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -54.02 -41.35 67.92 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.099 -0.5 . . . . 53.210000000000001 111.087 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.573 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 17.9 p90 -105.89 -6.11 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.667 -0.697 . . . . 72.430000000000007 110.601 -175.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.486 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 1.4 m-30 -59.3 -54.06 51.13 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.641 -0.254 . . . . 75.400000000000006 110.477 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.886 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.98 -47.88 61.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.305 0.574 . . . . 65.010000000000005 110.207 174.492 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -86.05 23.68 1.46 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.113 -0.949 . . . . 71.150000000000006 112.272 -169.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 36.2 mtm180 -95.24 -28.84 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.382 -0.824 . . . . 71.150000000000006 111.576 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.61 ' HB3' ' CG ' ' A' ' 37' ' ' MET . 0.1 OUTLIER -112.2 13.04 20.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.175 0.512 . . . . 65.129999999999995 110.195 -178.689 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 274' ' ' LYS . . . . . 0.479 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 81.8 tttt -64.34 -51.98 60.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.648 -0.705 . . . . 72.530000000000001 110.843 -176.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.5 -30.75 68.68 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.926 0.393 . . . . 73.239999999999995 110.676 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.0 -39.77 93.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.759 -0.655 . . . . 54.109999999999999 110.13 177.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.565 HD23 ' HB2' ' A' ' 45' ' ' ALA . 0.5 OUTLIER -67.99 -40.03 83.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.481 -0.782 . . . . 64.209999999999994 110.57 -176.45 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.06 -34.87 78.51 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.025 0.44 . . . . 64.230000000000004 110.68 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.63 65.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 44.329999999999998 110.886 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -91.42 -29.28 17.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 74.439999999999998 110.124 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.577 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.9 mmt -61.54 -60.21 4.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 75.329999999999998 109.78 173.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.702 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 72.8 mm-40 -57.23 -22.6 42.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.595 -0.729 . . . . 71.510000000000005 111.926 -177.053 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -47.83 -50.37 26.33 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.436 0.46 . . . . 43.039999999999999 110.867 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -100.15 -10.61 21.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.369 -0.378 . . . . 75.200000000000003 111.729 178.1 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.702 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 68.1 mt -74.25 -55.25 12.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.726 -0.39 . . . . 65.430000000000007 110.503 177.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.665 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.1 pt-20 -66.18 -34.74 78.72 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.678 -0.409 . . . . 70.010000000000005 110.524 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.11 8.37 33.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.357 -0.383 . . . . 21.43 111.361 -178.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.85 -56.14 24.11 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.064 -0.347 . . . . 75.409999999999997 110.064 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 116.213 -0.449 . . . . 73.329999999999998 111.527 -179.87 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 120.79 0.328 . . . . 73.230000000000004 110.598 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -90.54 -71.84 0.6 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.206 -0.665 . . . . 55.140000000000001 109.206 172.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -129.67 -46.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 62.039999999999999 110.049 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.89 164.45 22.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.937 -0.574 . . . . 42.25 111.599 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.543 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.4 OUTLIER -80.36 43.17 0.62 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.572 -0.74 . . . . 73.329999999999998 112.009 -175.589 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -44.49 -58.81 2.76 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.103 0.409 . . . . 74.420000000000002 112.103 -173.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.6 -21.64 53.98 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.171 0.804 . . . . 40.109999999999999 113.171 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -75.94 -49.22 18.38 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.338 -0.226 . . . . 72.219999999999999 111.032 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.69 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -71.01 -17.48 62.63 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.729 0.776 . . . . 73.439999999999998 109.933 -174.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.4 m -57.26 -37.41 72.31 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 114.453 -1.249 . . . . 64.230000000000004 111.292 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HB2' HD11 ' B' ' 217' ' ' LEU . 27.3 mt-10 -81.27 -21.13 39.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 73.329999999999998 110.276 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -69.1 -41.99 76.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 73.349999999999994 109.402 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.491 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.0 mt -74.07 -23.48 18.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.963 -0.562 . . . . 60.340000000000003 110.238 175.358 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 21.2 mmmt -58.67 -41.3 85.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 70.430000000000007 111.335 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.6 tm? -66.8 -31.38 71.97 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.266 -0.642 . . . . 45.119999999999997 109.266 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 -33.23 72.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.43 -0.805 . . . . 71.430000000000007 110.231 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.657 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 95.1 m-20 -61.39 -42.41 98.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.652 -0.704 . . . . 52.520000000000003 110.494 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.44 -27.38 67.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.947 -0.569 . . . . 75.140000000000001 111.461 -177.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -82.65 -30.13 29.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.276 0.56 . . . . 64.329999999999998 109.916 176.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -73.8 -20.07 60.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.501 -0.772 . . . . 51.310000000000002 110.356 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 89.7 mt-30 -64.2 -16.48 62.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.103 -0.498 . . . . 70.409999999999997 111.059 179.105 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -71.88 104.64 3.54 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.556 -0.535 . . . . 70.129999999999995 109.556 177.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -65.68 -34.53 78.43 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.46 -0.791 . . . . 60.020000000000003 111.912 -174.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -78.7 -5.78 54.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.325 0.491 . . . . 52.310000000000002 112.325 -176.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.2 mt -106.05 152.14 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.057 0.456 . . . . 63.240000000000002 110.222 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -79.35 155.96 28.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.76 -0.655 . . . . 74.340000000000003 109.68 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.1 m -69.84 -23.97 63.38 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.116 0.484 . . . . 72.109999999999999 110.431 -177.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.44 -14.62 74.72 Favored Glycine 0 C--N 1.333 0.396 0 CA-C-N 115.762 -0.654 . . . . 73.319999999999993 113.587 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -71.75 -37.92 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.416 0.608 . . . . 74.5 110.482 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 20.4 t -73.32 -43.03 57.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.598 -0.728 . . . . 74.150000000000006 110.695 -176.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.3 p -62.09 -44.11 97.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.085 0.469 . . . . 74.430000000000007 110.841 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.2 -32.92 74.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.812 -0.631 . . . . 60.450000000000003 111.14 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.7 m -65.89 -38.96 90.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.878 -0.416 . . . . 71.519999999999996 109.878 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . 0.717 ' HB3' HD13 ' B' ' 240' ' ' LEU . 1.2 t80 -67.12 -36.8 82.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.871 -0.604 . . . . 74.340000000000003 109.747 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.608 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.0 tpt -59.47 -53.76 54.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.157 -0.929 . . . . 54.549999999999997 110.473 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TRP . . . . . 0.469 ' NE1' ' HD2' ' A' ' 42' ' ' ARG . 18.1 t-105 -67.7 -38.7 84.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.943 -0.571 . . . . 75.439999999999998 111.42 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.47 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -62.4 -39.13 92.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.535 -0.302 . . . . 71.540000000000006 111.675 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.474 HD13 ' HB3' ' B' ' 236' ' ' PHE . 47.0 tp -65.44 -31.29 72.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.849 0.357 . . . . 75.530000000000001 110.574 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.18 90.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.248 -0.433 . . . . 74.450000000000003 110.918 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.469 ' HD2' ' NE1' ' A' ' 38' ' ' TRP . 28.8 mtp180 -68.84 -34.0 74.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 65.340000000000003 110.317 -177.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.434 ' HD2' HG23 ' B' ' 215' ' ' ILE . 6.0 t80 -76.64 -32.84 58.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.81 -0.632 . . . . 73.530000000000001 110.896 -175.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -79.21 -33.59 43.68 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.7 -0.227 . . . . 72.140000000000001 111.439 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.32 -17.93 64.97 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.189 0.518 . . . . 63.210000000000001 110.927 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -57.39 -32.32 66.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.193 -0.912 . . . . 74.319999999999993 111.062 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -85.05 1.68 46.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 61.130000000000003 111.969 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.59 -38.06 90.47 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.445 -0.883 . . . . 63.5 111.898 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.0 p -70.23 -17.9 63.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.85 0.357 . . . . 74.349999999999994 111.528 -177.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.2 p -92.44 -7.18 48.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 65.430000000000007 110.772 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -75.63 -35.96 60.35 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.229 -0.441 . . . . 52.350000000000001 111.677 -173.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.754 ' HE2' ' HG2' ' A' ' 61' ' ' LYS . 1.0 OUTLIER -147.27 175.67 10.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.329 0.585 . . . . 73.109999999999999 112.349 -175.8 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.629 ' HG3' HG23 ' A' ' 54' ' ' THR . 16.3 pt-20 -89.24 -37.08 15.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.08 -0.964 . . . . 73.030000000000001 111.546 -174.251 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.629 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.4 p -118.78 157.69 27.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 75.319999999999993 110.526 -177.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.475 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 21.2 ptmt -66.53 -29.95 70.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 73.540000000000006 110.503 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.34 -49.99 75.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.872 -0.604 . . . . 74.239999999999995 110.384 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.678 ' O ' ' HD3' ' A' ' 61' ' ' LYS . 96.6 mt-30 -78.08 -35.36 49.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.697 -0.683 . . . . 64.099999999999994 110.411 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 ttt -61.94 -41.29 97.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.049 0.452 . . . . 74.540000000000006 110.816 178.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.59 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.1 tt0 -65.47 -45.3 84.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.771 -0.65 . . . . 61.329999999999998 111.848 -176.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.36 -24.54 64.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.0 0.428 . . . . 64.329999999999998 111.355 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.754 ' HG2' ' HE2' ' A' ' 52' ' ' PHE . 3.9 mptp? -93.47 8.47 40.5 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 116.033 -0.531 . . . . 75.030000000000001 111.347 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.565 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 17.6 ptpt -51.7 -48.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.507 -0.553 . . . . 61.329999999999998 109.507 177.015 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.565 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 12.8 tp60 -72.22 -26.03 61.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.103 -0.498 . . . . 72.209999999999994 110.712 -176.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -81.84 -32.8 31.01 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 54.240000000000002 111.495 -176.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.8 ptp -83.36 -26.4 30.53 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 109.051 -0.722 . . . . 44.140000000000001 109.051 178.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.596 ' HG2' HD22 ' B' ' 277' ' ' LEU . 79.4 mtp -83.86 -4.68 58.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.16 -0.927 . . . . 64.299999999999997 111.756 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.59 -29.28 64.53 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.781 -0.822 . . . . 73.109999999999999 108.781 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 28.6 m-85 -99.93 -5.99 27.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.653 -1.158 . . . . 75.400000000000006 111.441 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.508 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 19.1 m-30 -77.3 -54.05 6.94 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.685 -1.228 . . . . 64.239999999999995 107.685 169.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.498 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -60.08 -66.27 0.55 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.308 -0.406 . . . . 71.540000000000006 110.21 171.313 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 10.6 t70 -95.44 82.62 3.7 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.437 0.532 . . . . 72.420000000000002 112.437 -171.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 8.8 mmm180 -153.15 -37.01 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.278 -0.419 . . . . 73.310000000000002 111.53 166.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.817 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -84.74 2.51 41.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 119.804 -0.758 . . . . 72.109999999999999 109.019 178.79 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.431 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 85.1 tttt -60.65 -50.55 73.05 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.039 -0.982 . . . . 65.099999999999994 110.079 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -37.19 85.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.255 -0.43 . . . . 75.049999999999997 111.113 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.5 mtt -63.01 -41.44 99.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.416 0.627 . . . . 74.400000000000006 109.919 177.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 1.3 tt -67.16 -43.06 83.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.815 -1.084 . . . . 73.010000000000005 109.86 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.84 -41.17 86.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.279 -0.873 . . . . 65.129999999999995 110.672 178.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.67 -10.36 59.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.413 -0.812 . . . . 70.239999999999995 111.987 -176.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.46 -3.17 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.783 -0.367 . . . . 72.5 111.463 -179.104 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' MET . . . . . 0.437 ' HE3' ' CD2' ' A' ' 77' ' ' LEU . 23.8 mtt -88.16 -177.77 5.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.287 0.565 . . . . 61.340000000000003 111.752 177.252 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.772 ' HG2' HD12 ' A' ' 85' ' ' ILE . 34.1 mt-10 66.77 -3.75 0.87 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.634 -1.166 . . . . 71.030000000000001 112.879 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -56.45 -39.39 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.129 0.49 . . . . 71.310000000000002 110.405 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -92.71 -16.14 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.971 -0.559 . . . . 74.25 110.514 178.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.772 HD12 ' HG2' ' A' ' 82' ' ' GLU . 62.0 mt -79.1 -55.58 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 65.219999999999999 110.808 -175.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.609 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.0 pt-20 -64.64 -31.19 72.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.124 0.488 . . . . 55.539999999999999 110.268 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -89.12 7.72 33.66 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.827 -0.624 . . . . 52.549999999999997 111.382 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.412 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 70.0 t80 -62.24 -40.81 97.39 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.072 -0.344 . . . . 75.540000000000006 110.072 178.553 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 C--N 1.331 -0.22 0 N-CA-C 109.402 -0.592 . . . . 61.039999999999999 109.402 176.617 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 203' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 3.2 p-10 . . . . . 0 N--CA 1.452 -0.362 0 N-CA-C 108.57 -0.9 . . . . 74.340000000000003 108.57 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 204' ' ' GLU . . . . . 0.563 ' H ' ' HD2' ' B' ' 208' ' ' TYR . 38.4 tt0 -85.51 -83.48 0.17 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.848 0.356 . . . . 73.319999999999993 111.092 -178.09 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -116.18 0.11 12.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.401 0.62 . . . . 73.420000000000002 110.739 -177.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 206' ' ' ALA . . . . . 0.561 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -143.29 179.9 6.8 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.175 -0.466 . . . . 70.120000000000005 111.629 -174.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 207' ' ' PHE . . . . . 0.429 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.2 OUTLIER -73.51 43.91 0.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.218 -0.901 . . . . 71.230000000000004 112.139 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 208' ' ' TYR . . . . . 0.563 ' HD2' ' H ' ' B' ' 204' ' ' GLU . 59.0 m-85 -60.52 -26.04 66.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.08 0.466 . . . . 75.030000000000001 110.991 -178.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -74.48 -24.04 58.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 72.329999999999998 111.539 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 210' ' ' ARG . . . . . 0.429 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 25.1 mmt180 -89.34 -57.67 2.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.569 -0.287 . . . . 71.430000000000007 111.446 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 211' ' ' ALA . . . . . 0.592 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.55 -26.79 14.21 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.575 0.583 . . . . 60.409999999999997 112.575 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 212' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 7.3 t -69.58 -20.72 63.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.553 0.216 . . . . 43.130000000000003 111.024 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 213' ' ' GLU . . . . . 0.454 ' HB2' HD11 ' A' ' 17' ' ' LEU . 38.9 mt-10 -85.45 -30.56 23.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.065 -0.717 . . . . 75.530000000000001 109.065 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 214' ' ' LEU . . . . . 0.592 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.01 -50.1 67.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.216 -0.902 . . . . 75.310000000000002 109.962 177.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 215' ' ' ILE . . . . . 0.47 HG13 ' HB1' ' A' ' 39' ' ' ALA . 82.3 mt -65.32 -30.98 51.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.864 -0.607 . . . . 71.019999999999996 110.74 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 216' ' ' LYS . . . . . 0.409 ' HD2' ' O ' ' B' ' 216' ' ' LYS . 0.5 OUTLIER -61.51 -29.8 70.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.892 -0.594 . . . . 71.230000000000004 110.799 -176.762 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 217' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.5 tm? -72.01 -41.39 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.493 -0.558 . . . . 73.310000000000002 109.493 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.7 -39.11 79.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.755 -0.657 . . . . 73.239999999999995 111.262 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 219' ' ' ASN . . . . . 0.651 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.1 m-20 -61.89 -34.19 75.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 75.150000000000006 111.31 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -65.64 -34.26 77.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.918 0.389 . . . . 74.540000000000006 111.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -79.67 -26.7 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.139 0.495 . . . . 74.230000000000004 110.406 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -79.27 -9.65 59.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.621 -0.718 . . . . 74.209999999999994 110.417 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 223' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 87.2 mm-40 -73.95 -10.58 59.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.323 -0.399 . . . . 62.43 110.79 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 224' ' ' ASN . . . . . 0.745 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 5.0 t-20 -70.68 112.34 6.84 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.833 -0.803 . . . . 63.009999999999998 108.833 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.7 t -47.85 -38.44 16.12 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 114.461 1.282 . . . . 63.329999999999998 114.461 -170.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -99.06 14.99 27.28 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.369 0.877 . . . . 60.009999999999998 113.369 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 227' ' ' ILE . . . . . 0.745 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 8.1 mm -96.7 154.21 3.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 O-C-N 121.472 -0.767 . . . . 43.399999999999999 110.062 177.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 228' ' ' GLN . . . . . 0.78 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 67.1 mt-30 -91.87 138.76 31.29 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.467 -0.938 . . . . 55.420000000000002 108.467 171.694 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 36.6 m -58.0 -27.63 63.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.151 0.5 . . . . 64.239999999999995 110.26 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -72.38 -11.6 76.22 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.512 -0.767 . . . . 74.219999999999999 113.631 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 231' ' ' GLU . . . . . 0.78 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 32.4 mt-10 -85.61 -27.54 25.39 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 117.886 0.843 . . . . 73.340000000000003 109.489 178.361 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.3 t -79.03 -39.48 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.356 -0.838 . . . . 70.340000000000003 110.175 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.6 p -61.08 -42.02 97.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.109 -0.496 . . . . 31.52 110.601 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.06 74.86 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.804 -0.635 . . . . 75.420000000000002 110.989 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 235' ' ' SER . . . . . 0.543 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 34.1 m -66.32 -37.45 85.41 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.867 0.365 . . . . 63.329999999999998 110.122 178.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 236' ' ' PHE . . . . . 0.661 ' CD1' HD12 ' A' ' 14' ' ' LEU . 9.6 t80 -64.6 -37.55 87.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.311 0.577 . . . . 72.219999999999999 109.463 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 237' ' ' MET . . . . . 0.817 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.4 ttm -66.39 -48.57 69.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.519 -0.764 . . . . 74.439999999999998 111.349 177.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 238' ' ' TRP . . . . . 0.485 ' O ' ' HG3' ' B' ' 242' ' ' ARG . 28.0 t-105 -62.14 -41.38 98.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.784 0.326 . . . . 74.510000000000005 110.981 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 239' ' ' ALA . . . . . 0.665 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -63.18 -39.29 94.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.84 0.353 . . . . 63.43 111.068 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 240' ' ' LEU . . . . . 0.717 HD13 ' HB3' ' A' ' 36' ' ' PHE . 42.5 tp -65.8 -36.12 82.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 72.530000000000001 110.503 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 241' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.1 -40.26 95.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.005 -0.543 . . . . 74.340000000000003 110.958 179.135 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 242' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' B' ' 238' ' ' TRP . 44.5 mtp180 -72.09 -37.27 69.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.221 -0.445 . . . . 70.140000000000001 110.073 -178.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -70.78 -40.93 72.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.803 -0.635 . . . . 63.039999999999999 111.013 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -69.28 -28.12 66.02 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.93 0.344 . . . . 63.350000000000001 111.93 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 245' ' ' ALA . . . . . 0.409 ' HB1' ' HG2' ' A' ' 81' ' ' MET . . . -68.82 -18.65 64.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.022 0.439 . . . . 64.430000000000007 111.324 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.8 t90 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.585 -0.734 . . . . 73.420000000000002 111.13 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -72.73 -5.77 40.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 64.530000000000001 112.457 -171.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 248' ' ' GLY . . . . . 0.553 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -58.88 -27.77 62.42 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.469 -0.872 . . . . 33.409999999999997 111.502 175.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 249' ' ' SER . . . . . 0.678 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 27.8 p -67.56 -21.2 65.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.558 -0.321 . . . . 75.140000000000001 111.426 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 26.5 p -91.12 -12.13 36.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.06 0.457 . . . . 74.439999999999998 111.039 -176.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 26.1 t -67.07 -42.53 84.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.659 . . . . 62.009999999999998 111.748 -172.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 252' ' ' PHE . . . . . 0.563 ' HD2' ' HG3' ' B' ' 261' ' ' LYS . 1.3 m-85 -150.61 -178.59 6.64 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.985 0.735 . . . . 74.120000000000005 112.985 -173.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 253' ' ' GLU . . . . . 0.514 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.5 pt-20 -93.13 -53.05 4.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.685 -1.143 . . . . 72.519999999999996 110.753 -176.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 254' ' ' THR . . . . . 0.514 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.0 p -100.84 158.57 15.88 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.086 -0.506 . . . . 73.019999999999996 110.505 -178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 255' ' ' LYS . . . . . 0.412 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.8 ptmt -68.36 -31.25 70.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.425 -0.352 . . . . 73.120000000000005 111.306 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.46 -45.51 93.44 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 54.100000000000001 110.673 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 257' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 90.6 mt-30 -80.49 -35.69 34.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 63.229999999999997 110.129 -179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 258' ' ' MET . . . . . 0.678 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.4 ttt -63.81 -44.89 91.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.512 -0.767 . . . . 61.530000000000001 111.447 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 259' ' ' GLN . . . . . 0.553 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.6 tt0 -61.3 -39.46 90.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.045 -0.525 . . . . 74.510000000000005 111.39 -178.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.68 63.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.158 -0.474 . . . . 74.239999999999995 111.328 -177.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 261' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' B' ' 252' ' ' PHE . 31.9 mmmt -97.51 -5.82 35.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.204 -0.453 . . . . 72.349999999999994 110.897 -176.579 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 262' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -52.67 -54.18 36.95 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.011 0.434 . . . . 71.299999999999997 110.477 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -68.02 -33.05 73.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.091 -0.504 . . . . 70.329999999999998 110.561 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.21 -40.38 78.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.72 -0.673 . . . . 74.239999999999995 111.763 -176.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 265' ' ' MET . . . . . 0.553 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 21.1 ptp -79.82 -25.61 40.77 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.488 0.661 . . . . 73.049999999999997 109.459 -177.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 266' ' ' MET . . . . . 0.43 ' HA ' ' CD2' ' B' ' 269' ' ' TYR . 44.5 mtp -78.32 -42.62 30.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.168 -0.924 . . . . 61.049999999999997 112.681 -176.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.61 -27.34 69.17 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.065 0.394 . . . . 64.230000000000004 112.065 -162.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 268' ' ' TYR . . . . . 0.579 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 30.2 p90 -94.15 -8.12 40.37 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.277 -0.569 . . . . 74.239999999999995 111.133 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 269' ' ' TYR . . . . . 0.43 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.5 m-30 -62.38 -49.69 74.54 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 110.004 -0.369 . . . . 74.439999999999998 110.004 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 270' ' ' MET . . . . . 0.469 ' O ' ' HG3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -53.54 -41.19 66.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.749 0.785 . . . . 63.009999999999998 109.427 175.314 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -86.75 8.85 20.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.516 -1.22 . . . . 74.329999999999998 111.66 -172.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 272' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 6.0 mmm-85 -84.09 -42.44 16.09 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 121.588 -0.695 . . . . 74.109999999999999 110.159 -174.245 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 273' ' ' TYR . . . . . 0.608 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.0 OUTLIER -99.61 14.94 28.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.698 -0.683 . . . . 71.120000000000005 110.318 -178.653 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -58.45 -58.67 7.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 75.409999999999997 109.64 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.2 -35.38 80.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.162 -0.927 . . . . 74.120000000000005 110.879 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.8 mtt -62.45 -42.43 99.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.857 -0.61 . . . . 70.310000000000002 110.285 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 277' ' ' LEU . . . . . 0.596 HD22 ' HG2' ' A' ' 66' ' ' MET . 1.6 tt -70.73 -38.9 73.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.208 -0.906 . . . . 54.450000000000003 110.088 -176.325 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -61.72 -35.37 77.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 71.25 110.048 175.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.54 -13.01 60.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.577 -0.738 . . . . 73.439999999999998 111.271 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -99.69 -9.25 23.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.571 0.701 . . . . 63.229999999999997 109.351 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 281' ' ' MET . . . . . 0.434 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.2 mmt -84.14 -170.07 2.9 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.85 -1.068 . . . . 65.439999999999998 109.786 174.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 282' ' ' GLU . . . . . 0.607 ' HA ' HD12 ' B' ' 285' ' ' ILE . 22.8 mt-10 72.09 -31.68 0.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.248 -0.887 . . . . 74.109999999999999 113.243 169.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -54.62 -54.79 36.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 45.43 110.954 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -68.4 -25.8 65.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.948 -0.569 . . . . 73.129999999999995 110.43 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 285' ' ' ILE . . . . . 0.607 HD12 ' HA ' ' B' ' 282' ' ' GLU . 54.6 mt -71.21 -56.24 11.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.18 -0.464 . . . . 60.210000000000001 110.76 -178.357 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 286' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -65.37 -27.91 68.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.063 0.458 . . . . 74.109999999999999 110.882 -178.001 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -94.53 10.3 35.18 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.431 -0.35 . . . . 72.340000000000003 111.497 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 288' ' ' PHE . . . . . 0.475 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 58.7 t80 -59.78 -48.81 80.2 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.18 -0.304 . . . . 74.409999999999997 110.18 177.32 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.331 -0.395 . . . . 72.349999999999994 110.936 177.817 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.7 t . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 110.013 -0.366 . . . . 75.25 110.013 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -79.51 -31.1 42.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.358 0.599 . . . . 72.409999999999997 109.691 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -122.05 139.94 53.1 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.436 -0.95 . . . . 65.239999999999995 108.436 174.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -82.3 -81.17 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.519 -0.472 . . . . 72.200000000000003 110.65 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -120.4 -11.47 9.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.134 0.492 . . . . 74.239999999999995 110.977 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . . . -108.68 169.52 8.61 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.94 -0.573 . . . . 44.119999999999997 111.547 -177.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.81 41.98 0.76 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.614 -0.721 . . . . 75.310000000000002 111.737 -176.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 6' ' ' ALA . 75.3 m-85 -50.35 -49.91 52.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.388 -0.369 . . . . 74.439999999999998 111.645 -176.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.11 88.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.921 -0.581 . . . . 61.420000000000002 111.819 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtm105 -72.46 -51.04 21.92 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.961 -0.296 . . . . 74.420000000000002 111.618 -176.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.627 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -60.5 -24.72 65.53 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.631 0.729 . . . . 61.340000000000003 110.796 -178.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -28.5 68.18 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.062 -0.972 . . . . 75.299999999999997 111.468 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.439 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.8 mt-10 -74.87 -29.21 60.95 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.37 0.605 . . . . 71.239999999999995 109.47 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -61.24 -45.94 92.47 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.872 -1.058 . . . . 64.239999999999995 109.694 177.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 65.1 mt -71.96 -27.06 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.713 -0.676 . . . . 71.409999999999997 110.276 177.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -31.94 73.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.063 -0.517 . . . . 61.109999999999999 110.431 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.583 HD12 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -68.34 -40.12 81.68 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.15 -0.685 . . . . 71.319999999999993 109.15 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.77 75.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 72.5 111.054 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.556 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 11.5 m-80 -58.52 -40.78 83.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 74.25 110.785 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -67.12 -34.83 78.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.85 -0.614 . . . . 73.329999999999998 111.655 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -76.93 -28.01 55.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.902 0.382 . . . . 75.219999999999999 110.675 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.45 ' HB2' HG21 ' A' ' 32' ' ' VAL . 65.9 t30 -83.81 -6.32 59.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 55.420000000000002 110.794 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 46.2 mt-30 -69.97 -11.2 60.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.388 -0.369 . . . . 75.099999999999994 111.861 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.735 ' HB3' ' CG1' ' A' ' 27' ' ' ILE . 2.8 t-20 -80.3 135.53 36.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.819 -0.437 . . . . 73.420000000000002 109.819 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -70.14 -40.58 74.71 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 113.197 0.814 . . . . 63.229999999999997 113.197 -170.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -87.43 1.33 53.72 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.433 0.531 . . . . 72.420000000000002 112.433 -174.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.735 ' CG1' ' HB3' ' A' ' 24' ' ' ASN . 13.2 mm -86.88 147.78 5.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.178 0.514 . . . . 61.210000000000001 109.658 178.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.763 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 2.2 mp0 -82.65 140.8 32.94 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.838 -0.801 . . . . 74.420000000000002 108.838 174.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.2 m -59.35 -28.18 66.6 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.147 -0.686 . . . . 73.209999999999994 109.147 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.526 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -74.09 -12.48 81.47 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.903 -1.044 . . . . 53.310000000000002 113.399 177.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.763 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 43.5 mt-10 -78.63 -35.56 45.33 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 118.079 0.94 . . . . 74.340000000000003 109.92 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.45 HG21 ' HB2' ' A' ' 22' ' ' ASN . 21.7 t -74.22 -40.86 51.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.732 -0.667 . . . . 72.420000000000002 110.605 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 p -61.52 -44.14 97.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.063 0.458 . . . . 64.319999999999993 110.255 176.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.43 -31.03 71.91 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.659 -0.701 . . . . 73.219999999999999 110.982 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 63.4 m -67.89 -42.46 81.17 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.029 -0.36 . . . . 73.340000000000003 110.029 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.602 ' CD1' HD12 ' B' ' 214' ' ' LEU . 4.0 t80 -64.61 -33.72 76.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.698 0.761 . . . . 74.409999999999997 109.093 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.658 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.1 tpt -62.23 -60.08 4.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.646 -1.161 . . . . 64.209999999999994 110.935 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.445 ' CZ2' ' HD3' ' A' ' 42' ' ' ARG . 25.7 t-105 -59.36 -33.89 71.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.354 -0.839 . . . . 65.519999999999996 111.303 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.482 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.34 -42.99 95.97 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.232 -0.44 . . . . 55.340000000000003 110.991 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.588 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.3 tp -68.83 -34.09 74.91 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 110.024 -0.361 . . . . 64.019999999999996 110.024 178.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -33.11 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 61.509999999999998 111.107 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.485 ' HG2' ' ND2' ' B' ' 280' ' ' ASN . 28.5 mtm180 -87.27 -45.59 10.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.387 -0.369 . . . . 64.420000000000002 111.061 178.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.517 ' HD2' HG23 ' B' ' 215' ' ' ILE . 18.5 t80 -68.18 -33.2 74.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.132 -0.485 . . . . 73.400000000000006 111.458 -173.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -86.49 -22.96 26.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.726 0.298 . . . . 73.310000000000002 111.6 -173.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.25 -10.4 59.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.45 0.643 . . . . 62.219999999999999 110.656 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -59.74 -24.9 64.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.014 -0.994 . . . . 72.049999999999997 111.57 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.403 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 75.3 m-85 -86.65 -0.53 56.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.039 0.385 . . . . 60.25 112.039 -176.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.12 -29.68 75.95 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 119.982 -1.104 . . . . 41.420000000000002 110.751 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.6 m -71.57 -5.45 33.41 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.254 -0.473 . . . . 64.450000000000003 111.825 -176.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -119.24 14.84 13.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.982 0.42 . . . . 71.230000000000004 111.15 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.95 -47.76 11.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 75.420000000000002 110.476 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.621 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 12.8 m-85 -142.47 165.07 28.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 116.121 -0.49 . . . . 65.239999999999995 110.145 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.428 ' HG2' ' N ' ' A' ' 54' ' ' THR . 1.6 pm0 -82.12 -41.77 20.03 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.136 -0.938 . . . . 64.140000000000001 111.362 -171.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.428 ' N ' ' HG2' ' A' ' 53' ' ' GLU . 65.4 p -100.92 149.16 24.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.99 -0.55 . . . . 75.450000000000003 109.739 178.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.504 ' HB2' HG23 ' B' ' 285' ' ' ILE . 13.2 pttm -68.07 -25.13 65.2 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.57 -0.53 . . . . 72.140000000000001 109.57 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -60.49 -49.77 76.22 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.536 -0.756 . . . . 52.100000000000001 110.574 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.54 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 98.0 mt-30 -81.08 -24.69 37.6 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.291 -0.413 . . . . 65.420000000000002 110.341 -178.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.497 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 11.7 ttt -71.8 -44.47 63.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.604 -0.725 . . . . 74.230000000000004 111.194 178.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 35.4 tt0 -62.68 -36.32 82.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 74.120000000000005 111.371 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.01 -15.03 63.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.152 0.501 . . . . 73.430000000000007 111.313 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.621 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 32.0 mmmt -99.13 1.58 45.17 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.178 -0.465 . . . . 73.319999999999993 111.054 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 0.2 OUTLIER -52.37 -48.52 65.53 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.457 0.473 . . . . 70.409999999999997 110.469 -176.465 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.596 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 5.4 tp-100 -72.3 -28.74 63.28 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.223 -0.444 . . . . 75.219999999999999 110.588 -175.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -78.17 -37.06 46.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.852 -0.613 . . . . 61.420000000000002 111.378 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 21.7 ptp -79.71 -26.12 40.95 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.092 -0.707 . . . . 62.109999999999999 109.092 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.53 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 88.7 mtp -81.23 -13.22 58.75 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.398 -0.819 . . . . 60.149999999999999 111.53 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -65.33 -26.96 68.27 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 122.115 0.96 . . . . 70.230000000000004 108.793 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -102.78 16.0 27.75 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.113 -1.403 . . . . 74.540000000000006 111.564 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.53 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.7 m-30 -106.83 -45.74 4.12 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.985 -0.746 . . . . 74.420000000000002 108.985 172.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -65.38 -60.66 2.73 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.983 0.421 . . . . 72.239999999999995 110.876 174.604 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -73.84 -16.6 61.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.34 1.237 . . . . 72.409999999999997 114.34 -168.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -96.92 3.04 52.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 113.641 0.978 . . . . 73.540000000000006 113.641 -158.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.582 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 7.42 11.51 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.652 -0.704 . . . . 72.209999999999994 109.203 167.623 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.439 ' O ' ' HE1' ' B' ' 266' ' ' MET . 2.6 pttm -78.78 -39.13 36.72 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.594 -0.73 . . . . 45.310000000000002 111.41 -172.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.544 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -70.23 -31.18 68.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.101 0.476 . . . . 70.329999999999998 110.04 -179.735 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.6 mtm -77.04 -27.97 54.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.68 -0.691 . . . . 62.030000000000001 110.038 176.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 6.8 tt -70.51 -46.86 62.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 61.450000000000003 109.778 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.436 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -60.34 -32.23 71.05 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.054 -0.521 . . . . 70.5 110.765 176.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.6 -15.31 62.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.919 -0.582 . . . . 64.409999999999997 111.48 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -104.9 -10.26 17.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.812 0.339 . . . . 75.209999999999994 110.537 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.44 ' O ' HG13 ' A' ' 85' ' ' ILE . 17.0 mmt -68.97 -48.36 63.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 74.150000000000006 110.511 177.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 24.0 mm-40 -56.54 -30.28 62.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.686 -0.688 . . . . 73.200000000000003 111.743 -177.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -56.03 -25.76 46.04 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.039 0.447 . . . . 74.209999999999994 110.975 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -107.69 -32.25 7.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.17 -0.468 . . . . 74.329999999999998 110.879 177.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 81' ' ' MET . 62.7 mt -70.61 -63.65 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 111.932 0.345 . . . . 70.519999999999996 111.932 -176.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.728 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 0.9 OUTLIER -76.81 -3.26 37.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.045 0.45 . . . . 70.219999999999999 111.268 -174.525 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -107.98 3.85 24.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.688 -0.687 . . . . 52.299999999999997 110.448 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -52.55 -52.84 52.95 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.293 -0.412 . . . . 74.400000000000006 110.936 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -58.13 -33.52 69.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.118 -0.492 . . . . 55.119999999999997 110.753 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -68.29 -51.82 40.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.167 -0.47 . . . . 74.140000000000001 110.414 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -64.97 -38.78 92.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.104 0.478 . . . . 72.310000000000002 110.598 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -62.99 -24.16 67.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.423 -0.808 . . . . 72.140000000000001 109.63 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -90.66 -11.86 38.54 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.71 -0.677 . . . . 64.409999999999997 111.189 -178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 54.0 p -99.79 -2.32 35.4 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.475 -0.329 . . . . 62.420000000000002 111.463 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.458 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 3.3 pt20 -99.88 105.94 17.72 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 122.004 0.907 . . . . 75.329999999999998 111.199 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.313 -1.017 0 CA-C-N 114.552 -1.204 . . . . 65.120000000000005 110.122 177.818 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 121.112 0.482 . . . . 63.210000000000001 110.499 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -90.59 5.09 49.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.966 -0.561 . . . . 71.25 110.161 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 -156.05 145.36 20.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.664 -0.698 . . . . 64.019999999999996 109.439 179.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -81.45 -90.58 0.07 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.899 0.381 . . . . 60.140000000000001 110.894 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -106.11 -26.14 11.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 54.140000000000001 110.679 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.434 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -100.23 162.35 13.02 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.117 -0.492 . . . . 71.109999999999999 111.161 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -75.9 43.83 0.28 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.42 -0.809 . . . . 72.099999999999994 112.602 -176.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' B' ' 206' ' ' ALA . 70.9 m-85 -54.17 -41.64 68.74 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.837 0.351 . . . . 73.129999999999995 111.321 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.7 -19.8 63.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.837 -0.62 . . . . 63.409999999999997 112.035 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.412 HH12 HD12 ' A' ' 27' ' ' ILE . 49.2 mtm180 -92.9 -56.97 2.79 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.943 -0.303 . . . . 75.230000000000004 110.799 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.715 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -51.51 -27.37 10.47 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.539 0.57 . . . . 52.520000000000003 112.539 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.6 t -69.5 -20.95 63.71 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 121.058 -0.257 . . . . 60.43 111.363 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.406 ' HB2' HD11 ' A' ' 17' ' ' LEU . 49.8 mt-10 -81.12 -29.46 34.82 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.254 -0.647 . . . . 70.5 109.254 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.715 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.0 mm? -63.64 -46.54 85.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.975 -1.011 . . . . 72.030000000000001 108.96 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.517 HG23 ' HD2' ' A' ' 43' ' ' TYR . 74.6 mt -67.59 -32.66 57.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.404 -0.816 . . . . 73.540000000000006 110.253 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 2.1 tmmt? -60.39 -36.86 79.09 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.64 -0.709 . . . . 75.310000000000002 111.167 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.528 HD12 HD13 ' A' ' 14' ' ' LEU . 3.2 tm? -63.27 -41.18 99.0 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.787 -0.82 . . . . 72.430000000000007 108.787 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.11 -28.99 68.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 53.340000000000003 110.849 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 5.8 m-20 -64.35 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 65.430000000000007 111.036 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -66.82 -39.95 87.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 62.409999999999997 111.196 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.84 -22.2 53.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.446 0.641 . . . . 75.019999999999996 109.945 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -81.34 -3.31 52.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.167 -0.924 . . . . 61.520000000000003 110.419 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 52.0 mt-30 -78.93 -8.18 58.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.421 -0.354 . . . . 52.340000000000003 110.864 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.84 105.21 12.78 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.646 -0.501 . . . . 72.310000000000002 109.646 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.6 t -59.43 -32.34 70.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.305 0.854 . . . . 75.340000000000003 113.305 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -79.01 -12.4 60.03 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.795 -0.362 . . . . 74.109999999999999 111.068 -175.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 10.0 mt -97.82 150.0 4.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.104 0.478 . . . . 63.210000000000001 109.966 -177.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -85.87 150.7 24.34 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.814 -0.63 . . . . 71.209999999999994 109.752 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.3 m -57.53 -23.92 53.08 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.674 -0.694 . . . . 73.409999999999997 110.277 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.403 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.96 -25.62 75.44 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.348 -0.842 . . . . 55.039999999999999 113.692 -179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -76.64 -13.58 60.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 117.876 0.838 . . . . 73.340000000000003 110.392 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 12.6 t -90.96 -42.06 13.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.705 -0.68 . . . . 50.240000000000002 109.858 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 25.2 p -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.112 -0.494 . . . . 74.349999999999994 110.642 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.65 -33.1 74.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.124 -0.489 . . . . 60.140000000000001 110.693 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 38.7 m -67.68 -40.76 84.4 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.921 -0.4 . . . . 73.140000000000001 109.921 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.625 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.9 t80 -63.07 -35.63 80.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.539 0.685 . . . . 75.519999999999996 109.478 176.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.588 ' SD ' HD21 ' A' ' 40' ' ' LEU . 8.4 tpt -59.45 -60.74 3.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.796 -1.093 . . . . 75.230000000000004 110.808 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.403 ' CZ2' ' HD3' ' B' ' 242' ' ' ARG . 25.3 t-105 -59.56 -36.26 75.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.228 -0.896 . . . . 74.540000000000006 111.532 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -64.41 -44.4 91.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.394 -0.366 . . . . 73.219999999999999 111.411 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.658 HD21 ' SD ' ' A' ' 37' ' ' MET . 43.5 tp -65.69 -33.94 77.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.4 . . . . 75.319999999999993 110.658 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.538 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.81 -43.6 97.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.95 -0.568 . . . . 32.240000000000002 110.924 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 242' ' ' ARG . . . . . 0.403 ' HD3' ' CZ2' ' B' ' 238' ' ' TRP . 68.6 mtm180 -70.95 -36.09 72.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 62.140000000000001 110.988 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -72.77 -39.17 66.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.336 -0.393 . . . . 65.329999999999998 110.725 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -72.69 -32.08 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.395 -0.366 . . . . 54.439999999999998 111.98 -177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -67.45 -14.74 63.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.971 0.415 . . . . 72.230000000000004 111.371 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 80.2 t90 -60.56 -38.68 85.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.052 -0.522 . . . . 61.399999999999999 110.962 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.526 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 62.0 m-85 -68.6 -13.92 62.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.288 0.477 . . . . 74.319999999999993 112.288 -175.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -61.44 -33.81 86.05 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.419 -0.896 . . . . 35.530000000000001 111.767 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.626 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 70.1 p -65.92 -23.75 66.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.807 0.336 . . . . 71.099999999999994 111.756 -176.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 14.5 t -108.83 22.19 16.24 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.227 0.537 . . . . 75.140000000000001 110.444 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.4 t -87.13 -55.32 3.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.175 -0.466 . . . . 64.209999999999994 110.939 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.624 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -130.03 -179.65 5.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.083 0.468 . . . . 74.540000000000006 111.842 -177.313 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.417 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.2 pt-20 -89.87 -41.85 11.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.238 -0.892 . . . . 75.340000000000003 111.539 -173.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.417 HG23 ' HG3' ' B' ' 253' ' ' GLU . 81.9 p -117.31 151.92 35.97 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 110.026 -0.361 . . . . 75.25 110.026 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.728 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 12.7 ptmm? -65.77 -25.8 67.42 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.373 0.421 . . . . 70.219999999999999 110.441 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -56.19 -54.58 43.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 73.329999999999998 110.217 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.643 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 85.8 mt-30 -79.43 -36.3 39.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.582 -0.735 . . . . 71.140000000000001 110.03 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.626 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 12.0 ttt -59.93 -46.79 88.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.488 -0.778 . . . . 62.119999999999997 111.577 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 33.5 tt0 -65.3 -30.27 71.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.953 0.406 . . . . 71.030000000000001 110.96 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -77.55 -9.94 59.21 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.17 -0.468 . . . . 64.209999999999994 110.897 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.643 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.8 mmmt -104.14 -1.13 27.72 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 116.263 -0.426 . . . . 61.399999999999999 110.693 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' B' ' 259' ' ' GLN . 17.1 ptpt -57.5 -45.51 84.84 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.39 -0.368 . . . . 55.450000000000003 110.963 -174.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.507 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 5.1 tp-100 -73.4 -19.56 60.96 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.058 -0.257 . . . . 75.209999999999994 110.924 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -83.26 -33.95 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 74.209999999999994 110.908 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' B' ' 262' ' ' LYS . 22.6 ptp -79.93 -26.99 39.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.962 -1.125 . . . . 72.049999999999997 107.962 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.45 ' HG2' HD22 ' A' ' 77' ' ' LEU . 73.1 mtp -89.92 23.86 2.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.55 -1.205 . . . . 73.420000000000002 110.168 174.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -104.28 -29.43 10.79 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.13 -1.063 . . . . 65.439999999999998 108.13 167.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.419 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.6 m-85 -98.21 9.24 43.43 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.685 -1.143 . . . . 61.100000000000001 112.039 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -94.71 -68.19 0.81 Allowed 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.543 -1.28 . . . . 74.140000000000001 107.543 166.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -51.3 -61.29 2.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.134 -0.939 . . . . 73.299999999999997 110.756 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -85.15 19.4 2.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.288 -0.869 . . . . 70.340000000000003 112.483 -166.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.419 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 17.6 mmm180 -121.72 -30.7 4.11 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 121.346 -0.846 . . . . 72.439999999999998 112.564 -175.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.47 ' HE2' ' HG ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -83.75 1.37 43.11 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.533 -1.284 . . . . 64.140000000000001 107.533 172.14 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.476 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 73.5 tttt -58.76 -58.26 9.37 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 112.929 -1.941 . . . . 71.420000000000002 111.279 178.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -32.51 74.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.445 . . . . 63.350000000000001 111.284 -176.028 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 39.1 mtm -78.59 -21.97 47.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.203 0.525 . . . . 64.230000000000004 110.08 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.448 HD22 ' HG2' ' A' ' 66' ' ' MET . 5.6 tt -76.43 -47.14 24.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.665 -0.698 . . . . 62.009999999999998 110.004 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 278' ' ' ASP . . . . . 0.405 ' HB2' ' HE1' ' A' ' 66' ' ' MET . 36.1 t70 -67.15 -26.21 66.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.208 0.528 . . . . 63.539999999999999 110.416 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.01 66.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.603 -0.726 . . . . 71.439999999999998 110.777 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 280' ' ' ASN . . . . . 0.485 ' ND2' ' HG2' ' A' ' 42' ' ' ARG . 35.7 m-80 -89.17 -30.04 18.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.305 -0.407 . . . . 63.240000000000002 110.244 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.623 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -56.08 -58.77 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 75.140000000000001 110.184 176.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 14.9 mm-40 -51.71 -37.33 50.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.612 -0.722 . . . . 75.450000000000003 112.081 -178.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.27 -52.37 65.6 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.255 0.347 . . . . 55.399999999999999 110.65 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -70.42 -38.29 74.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.399 -0.364 . . . . 64.420000000000002 110.941 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.623 HG13 ' O ' ' B' ' 281' ' ' MET . 61.3 mt -59.9 -59.61 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 73.409999999999997 111.312 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 5.9 pt-20 -60.0 -29.72 68.66 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.906 0.384 . . . . 65.109999999999999 111.204 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -90.86 9.44 30.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.423 -0.353 . . . . 72.430000000000007 111.602 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.46 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 39.1 t80 -60.49 -45.33 94.16 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.805 -0.443 . . . . 75.319999999999993 109.805 173.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -58.51 -20.61 47.46 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.929 -0.578 . . . . 74.140000000000001 110.616 176.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -89.56 -55.11 3.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.698 -0.683 . . . . 73.25 110.063 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -61.54 -38.31 86.96 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.335 -0.393 . . . . 73.540000000000006 111.976 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.504 ' NH2' ' HA ' ' B' ' 296' ' ' LYS . 5.1 tpm_? -65.44 -21.66 66.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.358 0.599 . . . . 74.329999999999998 110.378 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -92.14 -29.56 16.43 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.618 -0.719 . . . . 42.25 110.872 -175.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 24.1 p -83.54 -13.68 53.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.046 -0.525 . . . . 61.140000000000001 111.149 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -119.53 162.79 18.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.289 0.566 . . . . 72.010000000000005 111.217 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 296' ' ' LYS . . . . . 0.504 ' HA ' ' NH2' ' B' ' 292' ' ' ARG . 98.2 mttt . . . . . 0 C--O 1.25 1.107 0 CA-C-N 115.002 -0.999 . . . . 64.439999999999998 109.39 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.476 0.855 0 CA-C-O 120.902 0.382 . . . . 64.540000000000006 110.745 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -78.54 -39.02 39.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.257 0.551 . . . . 44.509999999999998 110.308 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 6' ' ' ALA . 83.9 m-20 -105.34 118.87 37.65 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.682 -0.69 . . . . 71.010000000000005 109.222 173.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -55.07 -73.09 0.06 Allowed 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.341 0.401 . . . . 65.109999999999999 111.402 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -133.22 -17.34 2.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.15 0.5 . . . . 74.209999999999994 110.694 177.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -107.48 163.27 13.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.96 -0.564 . . . . 51.420000000000002 111.674 -175.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.498 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.18 47.57 1.15 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.151 -0.931 . . . . 70.129999999999995 110.428 176.059 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 6' ' ' ALA . 73.2 m-85 -45.32 -52.09 10.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.032 -0.531 . . . . 74.450000000000003 111.492 -175.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.1 -34.93 74.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 55.520000000000003 111.972 -175.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -65.25 -54.05 35.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.374 -0.375 . . . . 74.409999999999997 110.497 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.69 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -74.19 -11.6 60.34 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.823 0.82 . . . . 65.25 110.265 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -70.23 -28.15 65.03 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.522 -1.217 . . . . 64.140000000000001 110.292 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.454 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.3 mm-40 -82.66 -27.3 31.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.48 0.657 . . . . 73.450000000000003 109.758 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -65.23 -49.89 67.94 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.081 -0.963 . . . . 64.530000000000001 109.446 176.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.505 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.1 mt -65.15 -30.17 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.796 -0.638 . . . . 74.129999999999995 110.201 175.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.721 ' HD3' HE22 ' A' ' 20' ' ' GLN . 5.3 tmtt? -57.98 -45.87 86.07 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.477 -0.783 . . . . 74.040000000000006 110.504 -179.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.465 HD12 HD13 ' B' ' 214' ' ' LEU . 1.8 tm? -56.04 -45.33 79.23 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.675 -0.491 . . . . 52.200000000000003 109.675 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.64 -28.43 65.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.688 -0.687 . . . . 63.549999999999997 111.287 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.626 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 23.4 m-80 -69.53 -26.89 64.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 71.219999999999999 111.374 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.721 HE22 ' HD3' ' A' ' 16' ' ' LYS . 2.6 mp0 -76.12 -30.54 58.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.246 0.546 . . . . 74.329999999999998 110.383 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -86.81 -16.98 34.57 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.89 -0.595 . . . . 64.239999999999995 110.007 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -84.57 -2.99 58.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.769 -0.65 . . . . 52.329999999999998 109.549 173.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 93.6 mt-30 -79.2 -2.16 39.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.807 -0.633 . . . . 74.030000000000001 109.718 173.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.594 HD22 HG13 ' A' ' 27' ' ' ILE . 2.3 t30 -74.84 106.85 6.57 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.1 -1.074 . . . . 54.0 108.1 172.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.2 t -53.53 -40.6 65.63 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 113.825 1.046 . . . . 62.229999999999997 113.825 -167.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -78.91 -21.01 47.98 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 112.36 0.504 . . . . 74.230000000000004 112.36 -176.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.594 HG13 HD22 ' A' ' 24' ' ' ASN . 11.1 mt -84.87 144.57 9.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.171 0.51 . . . . 74.519999999999996 110.139 -176.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.563 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -86.4 156.39 20.19 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.68 -0.691 . . . . 63.299999999999997 109.183 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.1 m -60.62 -30.55 69.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.292 0.567 . . . . 74.010000000000005 109.785 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.477 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -81.95 1.9 85.25 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.326 -0.852 . . . . 23.239999999999998 113.589 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.563 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 21.6 mm-40 -97.33 -19.46 18.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.85 0.825 . . . . 63.439999999999998 109.733 175.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.6 t -81.46 -25.92 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.739 -0.664 . . . . 72.120000000000005 110.169 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 p -59.9 -32.86 71.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.654 -0.703 . . . . 60.119999999999997 111.153 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.27 -34.3 75.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.187 -0.461 . . . . 52.219999999999999 110.71 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 m -69.26 -37.53 77.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 74.129999999999995 109.896 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.577 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 6.7 t80 -68.95 -35.16 76.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.743 -0.662 . . . . 73.019999999999996 109.644 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.765 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 3.9 ttm -70.7 -46.68 62.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.74 -0.664 . . . . 51.43 111.455 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -60.1 -39.57 86.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.108 0.48 . . . . 74.140000000000001 110.331 176.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.58 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.24 -39.7 93.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.895 -0.593 . . . . 74.120000000000005 111.115 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.769 HD21 ' SD ' ' B' ' 237' ' ' MET . 44.0 tp -65.04 -34.8 79.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.363 . . . . 71.140000000000001 110.475 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.99 -48.4 82.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.485 . . . . 65.340000000000003 110.75 177.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' OD1' ' B' ' 280' ' ' ASN . 20.7 mtm180 -68.81 -23.4 64.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 70.140000000000001 111.051 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.458 ' HD2' HG23 ' B' ' 215' ' ' ILE . 15.3 t80 -83.7 -31.35 26.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 72.420000000000002 110.735 -178.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -79.42 -26.01 41.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.786 0.326 . . . . 55.409999999999997 111.179 179.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB2' HD23 ' B' ' 277' ' ' LEU . . . -87.55 13.07 10.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.351 0.596 . . . . 42.439999999999998 110.784 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -76.81 -13.86 59.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.485 -0.779 . . . . 74.109999999999999 110.409 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.15 -86.87 0.34 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.429 -0.582 . . . . 74.420000000000002 109.429 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.67 -60.43 0.69 Allowed Glycine 0 C--N 1.333 0.361 0 O-C-N 123.357 0.411 . . . . 64.439999999999998 112.915 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.4 p -75.47 -1.6 24.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.221 0.534 . . . . 72.109999999999999 110.958 -176.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 p -65.84 -31.87 73.07 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.544 . . . . 52.340000000000003 111.392 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -74.22 -45.79 45.94 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.927 -0.579 . . . . 71.219999999999999 111.486 -178.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.518 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 15.9 m-85 -153.09 167.4 29.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.49 0.662 . . . . 52.539999999999999 112.106 -173.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 54' ' ' THR . 1.8 pm0 -91.18 -51.41 5.33 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.353 -1.294 . . . . 74.400000000000006 111.402 -175.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.546 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 65.6 p -90.14 148.26 23.09 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 116.678 -0.237 . . . . 74.219999999999999 110.514 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.493 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 13.9 ptmm? -66.28 -26.21 67.23 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.337 -0.392 . . . . 62.219999999999999 110.478 -176.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -57.39 -42.81 82.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.766 -0.652 . . . . 75.519999999999996 111.049 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 72.2 mt-30 -93.92 -35.57 12.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.969 -0.56 . . . . 63.310000000000002 110.039 -177.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.493 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 15.6 ttt -62.01 -47.88 82.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.364 -0.835 . . . . 74.510000000000005 111.449 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.81 -30.59 71.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 51.520000000000003 111.05 -176.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.88 -5.35 43.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.113 -0.494 . . . . 63.43 111.446 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.79 ' HE3' ' HG2' ' A' ' 64' ' ' GLU . 28.9 mmmt -116.04 5.36 13.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.448 -0.342 . . . . 70.150000000000006 110.201 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -57.58 -54.84 42.3 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.306 -0.406 . . . . 71.109999999999999 110.249 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -68.64 -27.92 66.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.222 -0.445 . . . . 74.219999999999999 110.37 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.79 ' HG2' ' HE3' ' A' ' 61' ' ' LYS . 5.5 tp10 -65.23 -45.28 85.3 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 116.033 -0.531 . . . . 74.25 110.857 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.642 ' HA ' ' HE1' ' A' ' 68' ' ' TYR . 20.5 ptp -77.75 -26.28 49.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.402 0.62 . . . . 41.229999999999997 109.375 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.467 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 65.6 mtp -80.94 -29.69 35.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.551 -0.75 . . . . 71.439999999999998 112.563 -177.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -64.22 -40.09 95.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.074 0.464 . . . . 75.329999999999998 110.725 -169.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.682 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 36.4 p90 -88.04 -12.15 45.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.931 -0.577 . . . . 71.239999999999995 110.493 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.474 ' O ' ' HE1' ' B' ' 237' ' ' MET . 2.3 m-30 -60.55 -44.7 95.83 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.229 -0.188 . . . . 71.530000000000001 110.623 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.687 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.55 -49.68 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.975 0.417 . . . . 61.32 110.05 173.679 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -85.19 47.91 1.49 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.605 0.717 . . . . 75.510000000000005 110.757 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.682 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 1.9 mmp_? -113.06 -23.07 10.23 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 121.705 -0.622 . . . . 73.209999999999994 111.158 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 1.035 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 9.1 11.86 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.621 -0.432 . . . . 65.109999999999999 110.983 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -64.05 -59.16 4.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.485 -0.325 . . . . 72.219999999999999 110.531 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -55.82 -37.83 69.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 74.239999999999995 111.321 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.8 mtt -61.79 -42.11 98.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.484 0.659 . . . . 71.25 110.332 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' B' ' 245' ' ' ALA . 2.0 tt -69.18 -36.28 77.16 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.229 -0.896 . . . . 75.439999999999998 109.304 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.483 ' N ' ' HE1' ' B' ' 266' ' ' MET . 12.1 t70 -61.45 -43.27 99.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.02 -0.991 . . . . 74.019999999999996 110.805 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.06 -14.28 62.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.514 -0.766 . . . . 73.540000000000006 111.814 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -99.55 -4.98 29.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.82 0.343 . . . . 72.239999999999995 111.004 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.44 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 19.0 mmt -80.73 -178.76 6.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.334 0.588 . . . . 60.229999999999997 111.569 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.713 ' HG2' HD12 ' A' ' 85' ' ' ILE . 3.8 mt-10 67.64 -2.33 1.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.641 -1.163 . . . . 74.409999999999997 114.059 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.96 -53.99 45.17 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.031 0.443 . . . . 55.130000000000003 109.95 177.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -85.4 -9.52 57.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 63.149999999999999 111.255 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.713 HD12 ' HG2' ' A' ' 82' ' ' GLU . 61.6 mt -79.34 -62.2 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.889 0.376 . . . . 62.130000000000003 110.897 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.618 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -66.8 -24.08 66.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.346 -0.388 . . . . 74.540000000000006 110.72 -176.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.55 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . 47.8 m-80 -107.07 16.69 23.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.057 -0.52 . . . . 71.430000000000007 111.111 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.553 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 63.3 t80 -53.94 -49.41 68.75 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.556 0.206 . . . . 75.5 111.556 -177.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -54.77 -27.86 44.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.067 0.46 . . . . 64.010000000000005 111.273 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -82.44 -55.78 4.28 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.061 -0.518 . . . . 71.349999999999994 110.249 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.55 ' CE2' ' HB2' ' A' ' 87' ' ' ASN . 72.8 m-85 -60.05 -39.82 87.3 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.838 0.351 . . . . 64.299999999999997 111.739 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.489 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 2.4 tmm_? -64.32 -25.53 68.08 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.471 -0.566 . . . . 63.420000000000002 109.471 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -94.08 -33.09 13.5 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.477 -0.783 . . . . 73.420000000000002 111.349 -174.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 39.9 p -99.88 9.81 42.36 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.048 0.388 . . . . 74.430000000000007 112.048 -177.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -64.35 158.86 22.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.001 0.429 . . . . 63.420000000000002 110.697 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.1 mttm . . . . . 0 C--N 1.319 -0.72 0 CA-C-N 115.85 -0.613 . . . . 72.140000000000001 110.578 -172.899 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 C--O 1.231 0.091 0 CA-C-O 121.174 0.511 . . . . 33.420000000000002 110.279 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -105.77 6.82 32.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.837 -0.619 . . . . 55.039999999999999 109.848 177.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.418 HD22 ' N ' ' B' ' 203' ' ' ASN . 0.9 OUTLIER -106.71 107.85 19.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.515 -0.766 . . . . 74.239999999999995 110.247 -178.695 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -96.35 100.28 11.9 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.18 -0.464 . . . . 74.549999999999997 110.794 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.9 25.22 3.9 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.748 0.785 . . . . 74.540000000000006 109.14 172.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -152.75 -176.24 5.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 74.450000000000003 111.904 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -130.16 42.15 3.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 71.310000000000002 110.254 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -52.14 -41.05 62.21 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.642 -0.708 . . . . 74.519999999999996 111.843 -177.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.09 -20.7 64.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 71.040000000000006 111.431 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -85.36 -65.2 1.04 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.287 -0.415 . . . . 71.439999999999998 110.091 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.627 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.82 -25.98 13.11 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.432 0.901 . . . . 70.420000000000002 113.432 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.8 t -65.63 -28.04 68.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.632 0.253 . . . . 72.409999999999997 111.318 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.7 -18.71 39.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.221 0.534 . . . . 65.109999999999999 110.251 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -71.37 -46.19 61.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.566 -0.743 . . . . 72.5 109.461 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.58 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.8 mt -67.2 -30.79 50.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.427 0.632 . . . . 72.549999999999997 109.905 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -57.55 -39.96 77.84 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.188 -0.914 . . . . 75.430000000000007 111.084 -177.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 14' ' ' LEU . 2.8 tm? -63.66 -42.6 98.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.354 -0.385 . . . . 71.439999999999998 110.052 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.41 -33.2 72.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 43.549999999999997 111.402 -177.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.79 -32.73 73.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.304 -0.407 . . . . 72.209999999999994 111.109 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -74.14 -28.22 61.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 72.439999999999998 111.264 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -85.18 -21.18 29.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.923 0.392 . . . . 74.510000000000005 110.519 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -78.13 -1.97 35.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.469 0.652 . . . . 73.439999999999998 109.854 175.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -79.45 -4.43 51.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.877 -0.601 . . . . 54.520000000000003 109.944 175.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.475 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -69.93 103.52 2.26 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.955 -0.758 . . . . 44.420000000000002 108.955 175.32 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.9 t -59.86 -26.51 65.91 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 113.287 0.847 . . . . 73.510000000000005 113.287 -171.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 226' ' ' GLU . . . . . 0.475 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.6 pm0 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.226 0.454 . . . . 64.329999999999998 112.226 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.41 HG13 HD22 ' B' ' 224' ' ' ASN . 4.2 mt -115.97 150.47 17.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.395 . . . . 72.319999999999993 110.943 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -88.76 166.35 14.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.094 -0.503 . . . . 74.099999999999994 109.783 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 10.4 m -67.22 -27.01 66.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.301 -0.409 . . . . 74.430000000000007 110.659 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -66.52 -27.44 73.16 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.938 -0.574 . . . . 61.25 113.322 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -74.4 -29.36 61.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.223 0.535 . . . . 73.340000000000003 109.778 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.8 t -76.29 -26.23 16.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 70.450000000000003 109.695 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 233' ' ' SER . . . . . 0.445 ' HA ' ' CE1' ' A' ' 43' ' ' TYR . 2.7 m -65.57 -24.68 67.15 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.819 -0.628 . . . . 75.420000000000002 109.75 174.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -85.51 -33.06 21.89 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.597 -0.729 . . . . 61.43 111.348 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.498 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 9.2 p -68.77 -34.36 75.44 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 120.7 -0.4 . . . . 61.210000000000001 110.41 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.64 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.3 t80 -67.18 -36.33 81.56 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.14 -0.689 . . . . 71.340000000000003 109.14 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 237' ' ' MET . . . . . 1.035 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.4 tpt -62.66 -57.5 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.142 -0.935 . . . . 64.120000000000005 110.554 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.498 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 31.1 t-105 -60.23 -35.62 75.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.455 -0.793 . . . . 73.209999999999994 111.643 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.504 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -62.65 -47.11 85.13 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.701 0.286 . . . . 71.400000000000006 110.945 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.562 HD13 ' HB3' ' A' ' 36' ' ' PHE . 40.0 tp -62.83 -28.21 69.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 72.120000000000005 110.872 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -66.09 -49.44 67.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 45.43 110.908 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.6 mtm180 -68.76 -23.7 64.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.401 . . . . 53.509999999999998 110.862 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.505 ' HD2' HG23 ' A' ' 15' ' ' ILE . 13.7 t80 -78.9 -26.41 43.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.238 -0.437 . . . . 73.510000000000005 110.58 -179.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -90.61 -24.75 20.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.854 0.316 . . . . 72.530000000000001 111.854 -178.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.488 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -83.66 2.3 38.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.532 0.682 . . . . 60.539999999999999 110.285 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -76.3 -9.21 58.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.803 -1.09 . . . . 64.430000000000007 109.929 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.56 ' HB3' ' OG1' ' B' ' 250' ' ' THR . 80.2 m-85 -95.94 -89.07 0.26 Allowed 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.912 -0.773 . . . . 75.319999999999993 108.912 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . 64.63 -66.73 0.07 OUTLIER Glycine 0 C--N 1.334 0.437 0 O-C-N 123.663 0.602 . . . . 52.030000000000001 113.325 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 3.5 p -75.06 -3.34 31.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.107 0.48 . . . . 63.5 111.043 -175.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 250' ' ' THR . . . . . 0.56 ' OG1' ' HB3' ' B' ' 247' ' ' PHE . 24.1 p -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.948 -0.569 . . . . 75.299999999999997 111.038 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.2 t -86.4 -39.88 15.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.897 -0.592 . . . . 63.310000000000002 111.236 -177.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.55 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 4.0 m-85 -147.67 179.24 7.84 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.772 0.656 . . . . 75.219999999999999 112.772 -173.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.505 ' HG3' ' N ' ' B' ' 254' ' ' THR . 7.9 pt-20 -89.7 -50.98 5.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.035 -0.984 . . . . 64.049999999999997 111.334 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.54 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 68.9 p -107.33 159.44 16.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.071 -0.513 . . . . 61.409999999999997 111.063 -173.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.553 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 20.2 ptmt -67.28 -32.07 72.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.471 -0.331 . . . . 74.510000000000005 110.814 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 256' ' ' GLU . . . . . 0.54 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.7 mp0 -57.56 -42.73 83.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.167 0.508 . . . . 74.439999999999998 110.46 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 78.7 mt-30 -89.7 -34.97 16.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.677 -0.692 . . . . 63.5 110.266 -177.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.404 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 14.8 ttt -63.5 -42.34 98.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.828 -0.624 . . . . 74.349999999999994 110.892 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.581 ' HG3' ' HE3' ' B' ' 262' ' ' LYS . 34.6 tt0 -62.64 -37.3 85.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 71.340000000000003 111.005 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.17 -9.0 50.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 52.420000000000002 111.159 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.55 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 30.9 mmmt -109.21 1.07 20.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.115 -0.493 . . . . 64.140000000000001 111.529 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.581 ' HE3' ' HG3' ' B' ' 259' ' ' GLN . 8.2 ptpp? -58.38 -39.74 80.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.711 0.291 . . . . 64.439999999999998 110.594 -175.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -90.1 -24.48 21.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 110.085 -0.339 . . . . 65.140000000000001 110.085 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 264' ' ' GLU . . . . . 0.415 ' HB2' ' HA ' ' B' ' 261' ' ' LYS . 45.8 mt-10 -75.17 -33.26 61.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 61.140000000000001 111.802 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.2 ptp -77.87 -30.42 50.82 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.073 -1.084 . . . . 72.109999999999999 108.073 175.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.483 ' HE1' ' N ' ' A' ' 78' ' ' ASP . 45.2 mtp -87.33 16.47 5.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.981 -1.008 . . . . 70.030000000000001 110.703 177.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -91.79 -37.71 12.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.249 0.547 . . . . 54.009999999999998 110.072 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.512 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 13.9 p90 -109.06 -5.91 15.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.879 -0.6 . . . . 63.439999999999998 110.925 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -57.75 -48.01 80.86 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.634 0.254 . . . . 75.409999999999997 110.752 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.687 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.71 -53.37 58.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.923 -0.581 . . . . 62.020000000000003 110.809 175.443 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.39 65.21 8.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.366 0.603 . . . . 74.420000000000002 111.444 -173.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.597 ' HB2' ' SD ' ' A' ' 37' ' ' MET . 85.2 mtm180 -125.63 -27.83 3.35 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.78 -0.645 . . . . 73.219999999999999 109.522 170.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.765 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -104.1 14.45 30.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.282 -0.417 . . . . 54.25 110.441 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -63.99 -58.76 5.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 75.25 109.828 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.51 -36.03 79.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 74.340000000000003 111.146 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 61.0 mtt -58.02 -46.77 84.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.316 0.579 . . . . 61.43 109.663 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.511 HD23 ' HB2' ' A' ' 45' ' ' ALA . 0.9 OUTLIER -67.02 -37.73 84.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.814 -1.085 . . . . 62.420000000000002 109.729 -177.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 278' ' ' ASP . . . . . 0.467 ' N ' ' HE1' ' A' ' 66' ' ' MET . 13.8 t70 -64.06 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.499 -0.773 . . . . 75.120000000000005 110.092 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -72.37 -18.3 61.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.661 -0.7 . . . . 63.520000000000003 111.144 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 280' ' ' ASN . . . . . 0.444 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m120 -89.64 -20.07 24.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.066 0.46 . . . . 72.239999999999995 109.798 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.46 ' C ' ' H ' ' B' ' 283' ' ' ASP . 24.3 mmt -73.67 -165.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 74.299999999999997 110.172 173.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 6.5 mm-40 66.48 -34.59 0.21 Allowed 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.339 1.056 . . . . 75.010000000000005 112.989 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 283' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' B' ' 281' ' ' MET . 18.2 t70 -47.9 -60.07 2.87 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.436 0.694 . . . . 63.420000000000002 112.236 -177.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -80.55 -13.33 59.16 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.213 -0.449 . . . . 65.439999999999998 110.808 -177.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 285' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.79 -53.61 13.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.116 -0.493 . . . . 72.109999999999999 110.307 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.596 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -63.15 -32.21 73.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.137 -0.483 . . . . 72.340000000000003 110.211 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 287' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 30.1 m-80 -90.49 11.96 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.792 -0.64 . . . . 75.310000000000002 111.922 -176.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 54' ' ' THR . 38.3 t80 -58.18 -43.4 87.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.86 -0.793 . . . . 74.420000000000002 108.86 172.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -54.7 -47.92 73.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.47 -0.786 . . . . 63.530000000000001 110.343 173.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -55.92 -59.29 5.1 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.923 -0.58 . . . . 74.329999999999998 111.006 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -70.49 -36.39 73.8 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.548 0.573 . . . . 64.230000000000004 112.548 -172.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -72.07 -21.16 61.56 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.776 -0.369 . . . . 72.099999999999994 110.206 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -86.36 -40.84 15.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.198 0.523 . . . . 72.010000000000005 110.289 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.0 p -98.46 29.17 3.75 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.604 -0.726 . . . . 74.239999999999995 110.135 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -60.41 161.7 7.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.762 -1.108 . . . . 71.329999999999998 112.615 -175.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 67.4 mttm . . . . . 0 C--O 1.248 0.977 0 CA-C-N 114.329 -1.305 . . . . 73.530000000000001 109.276 -178.009 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 110.068 -0.345 . . . . 73.450000000000003 110.068 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -78.98 79.13 5.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.247 0.546 . . . . 63.340000000000003 110.351 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.491 ' HA ' ' HD2' ' A' ' 8' ' ' TYR . 4.6 p-10 -151.74 105.35 3.12 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.783 0.801 . . . . 72.340000000000003 109.209 174.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -84.22 -72.25 0.47 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.313 -0.858 . . . . 71.319999999999993 112.212 -169.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -89.46 -15.11 33.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.295 0.569 . . . . 55.210000000000001 110.712 -171.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . . . -139.13 167.11 22.8 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.944 -0.571 . . . . 75.230000000000004 111.615 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.53 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.66 47.35 1.17 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.17 -0.923 . . . . 73.230000000000004 111.398 -179.171 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.491 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 68.7 m-85 -49.66 -42.22 44.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.378 . . . . 74.120000000000005 111.907 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.18 -18.8 64.7 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.194 0.442 . . . . 73.510000000000005 112.194 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -83.62 -53.92 5.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.527 0.203 . . . . 73.510000000000005 111.06 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.752 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -66.74 -17.04 64.66 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.89 0.853 . . . . 45.030000000000001 109.932 -176.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -55.53 -35.93 66.19 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.03 -1.441 . . . . 74.439999999999998 111.535 175.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.658 ' HB2' HD11 ' B' ' 217' ' ' LEU . 25.6 mt-10 -83.68 -24.82 31.13 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.125 0.488 . . . . 74.5 110.126 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -67.12 -44.55 79.61 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.66 -0.7 . . . . 73.409999999999997 109.9 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 67.5 mt -73.48 -22.98 19.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.811 -0.631 . . . . 45.140000000000001 110.357 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -62.04 -34.98 77.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.889 -0.596 . . . . 70.439999999999998 110.622 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.561 HD12 HD13 ' B' ' 214' ' ' LEU . 2.5 tm? -72.71 -39.72 66.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.476 -0.564 . . . . 61.130000000000003 109.476 176.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.86 95.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.222 0.534 . . . . 71.230000000000004 110.23 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 88.7 m-20 -65.26 -23.09 66.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.869 -0.605 . . . . 73.140000000000001 110.908 177.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -74.1 -35.8 64.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.102 0.477 . . . . 42.119999999999997 110.149 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -81.23 -23.57 37.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.267 0.556 . . . . 54.130000000000003 110.137 178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -81.63 9.37 7.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.495 0.664 . . . . 73.129999999999995 110.201 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 96.7 mt-30 -83.81 -5.99 59.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.944 -0.571 . . . . 74.319999999999993 110.34 175.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -78.36 109.81 12.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.762 . . . . 62.399999999999999 108.941 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 25' ' ' THR . 3.7 t -65.35 -30.2 71.02 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.916 0.71 . . . . 52.229999999999997 112.916 -170.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -86.12 -11.73 51.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.761 0.652 . . . . 72.040000000000006 112.761 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 11.0 mt -96.05 144.97 9.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.38 0.61 . . . . 70.420000000000002 110.401 -178.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.524 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -79.7 153.64 29.15 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.272 -0.876 . . . . 75.450000000000003 109.703 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.4 m -62.63 -20.88 65.22 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.965 -0.561 . . . . 65.239999999999995 111.212 -177.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.72 -27.11 72.93 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.903 -0.59 . . . . 63.030000000000001 113.73 -177.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 12.0 mm-40 -75.35 -18.96 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.525 0.663 . . . . 63.130000000000003 110.262 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -86.46 -43.35 16.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.66 -0.7 . . . . 64.439999999999998 110.249 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.408 ' HB3' ' CD1' ' B' ' 243' ' ' TYR . 10.7 p -61.59 -39.26 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.111 -0.495 . . . . 62.219999999999999 110.519 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.67 -33.06 75.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.912 -0.585 . . . . 45.140000000000001 111.11 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.3 m -69.49 -35.77 75.88 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 43.229999999999997 110.059 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.512 ' CD1' HD12 ' B' ' 214' ' ' LEU . 8.1 t80 -67.9 -34.65 77.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.32 0.581 . . . . 74.230000000000004 109.509 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.806 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 13.0 ttm -67.0 -51.24 57.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.465 -0.789 . . . . 74.420000000000002 111.54 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 30.1 t-105 -60.65 -37.1 80.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.851 0.357 . . . . 73.230000000000004 110.584 178.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.56 -37.35 86.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 74.510000000000005 111.278 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.52 HD13 ' HB3' ' B' ' 236' ' ' PHE . 47.3 tp -70.01 -32.51 70.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.05 0.452 . . . . 61.009999999999998 110.22 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.522 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.45 -42.05 98.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.663 -0.699 . . . . 73.150000000000006 110.845 178.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 42' ' ' ARG . 39.5 mtp180 -69.94 -37.31 75.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.096 0.474 . . . . 75.450000000000003 110.558 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -74.54 -34.81 63.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.789 -0.641 . . . . 62.219999999999999 111.405 -173.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.7 m-20 -74.61 -28.82 61.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.644 0.259 . . . . 54.109999999999999 111.495 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.6 -19.25 63.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.554 . . . . 62.109999999999999 111.055 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -61.9 -27.88 69.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.128 -0.942 . . . . 73.25 110.738 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.476 ' O ' HG22 ' A' ' 50' ' ' THR . 60.0 m-85 -90.41 10.36 25.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.367 -0.379 . . . . 70.319999999999993 111.718 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.508 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.41 -27.16 73.5 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.416 -0.897 . . . . 71.219999999999999 111.423 176.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.776 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 26.1 p -67.57 -27.97 67.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 71.120000000000005 111.313 -177.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.3 t -90.89 12.83 18.25 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.152 0.501 . . . . 52.210000000000001 110.729 -176.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.1 t -78.99 -65.64 0.97 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.248 -0.433 . . . . 65.099999999999994 111.534 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.729 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 5.8 m-85 -133.02 -176.05 3.99 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.559 0.578 . . . . 71.329999999999998 112.559 -172.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.1 pt-20 -92.62 -48.69 6.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.065 -0.97 . . . . 63.009999999999998 111.415 -172.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.487 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.3 p -105.25 156.59 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.244 -0.435 . . . . 60.149999999999999 110.065 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.515 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.8 ptmm? -70.52 -25.28 63.05 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.837 -0.345 . . . . 75.25 110.882 -175.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -72.05 -42.21 66.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.084 -0.246 . . . . 71.019999999999996 110.917 -178.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.763 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 98.8 mt-30 -74.15 -45.15 50.53 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 73.040000000000006 109.637 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.776 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 17.2 ttt -57.88 -40.68 80.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 72.120000000000005 111.684 -179.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.541 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.5 tt0 -63.53 -36.59 84.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.95 0.405 . . . . 72.109999999999999 111.14 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.77 9.37 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.127 -0.488 . . . . 72.450000000000003 111.12 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.763 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 71.5 mmtt -115.21 -1.99 12.82 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-N 116.223 -0.444 . . . . 73.0 110.241 -177.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.478 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.2 ptmt -54.38 -56.5 18.01 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.431 -0.804 . . . . 62.240000000000002 110.393 -178.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.478 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.0 tp60 -70.25 -23.17 62.85 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.775 -0.193 . . . . 64.0 110.627 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -71.17 -41.48 70.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.44 -0.345 . . . . 62.020000000000003 110.612 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.508 ' SD ' ' HA2' ' A' ' 48' ' ' GLY . 20.2 ptp -81.96 -25.44 34.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.487 0.661 . . . . 71.299999999999997 109.309 -179.154 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.486 ' HG2' HD22 ' B' ' 277' ' ' LEU . 69.3 mtp -82.03 -25.25 34.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.426 -0.806 . . . . 75.140000000000001 111.785 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 23.9 t70 -64.23 -33.09 75.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.965 0.412 . . . . 74.319999999999993 110.582 -169.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -98.01 -14.28 20.64 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.021 -0.536 . . . . 74.400000000000006 110.548 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.439 ' HB2' ' HA ' ' A' ' 66' ' ' MET . 1.0 OUTLIER -57.66 -53.3 59.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 110.08 -0.341 . . . . 65.530000000000001 110.08 174.771 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.783 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -46.98 -58.53 3.87 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.615 -0.72 . . . . 73.430000000000007 110.879 174.877 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.595 ' OD1' ' HG2' ' B' ' 270' ' ' MET . 5.7 t0 -91.96 28.44 1.84 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.867 -0.606 . . . . 73.319999999999993 111.605 -169.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.446 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 4.6 mtp180 -84.45 -42.39 15.67 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.043 0.449 . . . . 63.329999999999998 110.555 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.75 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.0 OUTLIER -87.78 19.58 3.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.258 0.551 . . . . 73.549999999999997 109.686 -178.445 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 25.2 tttp -57.11 -66.0 0.53 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.039 -0.982 . . . . 74.310000000000002 110.732 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -64.41 -27.23 68.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 64.209999999999994 110.949 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.4 mtt -66.3 -38.02 86.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.484 0.659 . . . . 72.409999999999997 110.067 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.57 HD22 ' HG2' ' B' ' 266' ' ' MET . 5.4 tt -76.83 -37.37 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.246 -0.888 . . . . 73.209999999999994 109.811 -178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.623 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 13.2 t70 -59.55 -41.19 89.56 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.962 -0.563 . . . . 74.409999999999997 110.421 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.24 -5.63 33.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.287 -0.87 . . . . 64.209999999999994 111.83 -177.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -105.67 -4.44 21.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.954 -0.298 . . . . 75.109999999999999 111.205 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 51.7 mtt -95.86 -172.87 2.69 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.842 0.353 . . . . 74.120000000000005 110.839 175.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.697 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 36.3 mt-10 67.12 -6.5 0.58 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.021 0.928 . . . . 74.329999999999998 113.466 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.56 -54.91 38.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.74 0.305 . . . . 51.420000000000002 110.783 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -9.12 49.03 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 120.959 0.409 . . . . 61.310000000000002 110.179 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.697 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -70.43 -57.03 8.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.869 0.366 . . . . 43.149999999999999 110.077 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -68.45 -17.95 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 73.439999999999998 110.733 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -109.32 14.56 23.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 60.530000000000001 111.487 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -58.68 -51.82 68.32 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.73 0.3 . . . . 74.510000000000005 110.296 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -61.75 -36.48 81.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.097 -0.501 . . . . 71.530000000000001 110.273 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -60.24 -56.37 22.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.708 -0.678 . . . . 72.040000000000006 110.514 177.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -62.61 -47.82 82.09 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.441 -0.345 . . . . 71.299999999999997 111.207 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 92' ' ' ARG . 0.1 OUTLIER -60.2 -20.87 60.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.896 -0.593 . . . . 71.319999999999993 110.948 -178.136 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -88.25 -31.12 19.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.107 -0.497 . . . . 64.5 110.844 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 24.9 p -82.62 -26.1 32.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.166 -0.47 . . . . 74.530000000000001 111.376 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -88.95 156.75 18.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.879 0.371 . . . . 73.129999999999995 110.231 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.432 ' HD2' ' N ' ' A' ' 96' ' ' LYS . 6.2 mptt . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 116.129 -0.487 . . . . 65.5 110.434 -174.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.232 0.138 0 CA-C-O 121.205 0.526 . . . . 62.030000000000001 110.641 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -154.8 103.32 2.42 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.719 -0.673 . . . . 45.100000000000001 109.779 178.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -169.68 148.49 3.66 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.71 -0.478 . . . . 74.120000000000005 109.71 -178.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -78.34 -81.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.57 -0.286 . . . . 74.310000000000002 110.479 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -112.23 -47.06 3.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.896 0.379 . . . . 70.200000000000003 110.623 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -80.26 155.84 27.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.031 0.443 . . . . 64.349999999999994 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.11 51.93 0.7 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.379 -0.828 . . . . 60.100000000000001 112.602 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -56.99 -32.96 66.63 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.976 0.362 . . . . 62.399999999999999 111.976 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -81.1 -7.72 59.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.888 0.329 . . . . 62.200000000000003 111.888 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -94.1 -62.5 1.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.371 -0.233 . . . . 71.510000000000005 110.371 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.725 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.75 -26.34 13.86 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.844 0.683 . . . . 60.130000000000003 112.844 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.01 -18.5 65.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.187 -0.205 . . . . 71.209999999999994 111.534 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.51 -25.61 22.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.296 0.569 . . . . 52.329999999999998 109.573 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.725 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.64 -47.32 69.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 73.209999999999994 109.475 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.456 HG13 ' HB1' ' A' ' 39' ' ' ALA . 71.1 mt -66.56 -29.96 48.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.47 -0.786 . . . . 71.510000000000005 110.667 178.154 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -59.14 -36.51 75.36 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.925 -0.58 . . . . 74.099999999999994 110.758 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.658 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.5 tm? -68.65 -43.75 75.59 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.432 -0.581 . . . . 70.340000000000003 109.432 178.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 218' ' ' ALA . . . . . 0.404 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -60.2 -40.9 91.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 42.530000000000001 110.613 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.577 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 84.8 m-20 -60.36 -30.85 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 71.319999999999993 111.199 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.53 -30.05 62.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.338 . . . . 73.010000000000005 111.18 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -84.26 -24.33 29.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.584 0.707 . . . . 73.549999999999997 109.804 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -72.63 -9.47 58.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.881 -1.054 . . . . 72.409999999999997 110.127 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 93.9 mt-30 -76.99 -6.96 54.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.729 -0.669 . . . . 72.230000000000004 111.252 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -72.77 111.86 8.29 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.603 -0.517 . . . . 64.409999999999997 109.603 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 225' ' ' THR . . . . . 0.434 ' H ' HG22 ' B' ' 225' ' ' THR . 1.8 t -61.78 -35.51 78.36 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.142 0.793 . . . . 71.209999999999994 113.142 -171.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.57 -1.22 57.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.589 0.589 . . . . 73.219999999999999 112.589 -176.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 7.0 mt -107.69 153.19 9.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 C-N-CA 120.621 -0.432 . . . . 61.149999999999999 110.125 178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.685 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 10.4 pt20 -91.99 159.04 15.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.592 -0.521 . . . . 63.399999999999999 109.592 177.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 1.1 m -59.67 -26.56 65.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.253 -0.43 . . . . 64.319999999999993 111.141 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -65.84 -26.36 72.15 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.629 -0.714 . . . . 62.509999999999998 113.695 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.685 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 5.7 mm-40 -78.8 -24.53 44.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.387 0.593 . . . . 71.239999999999995 109.615 -178.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 232' ' ' VAL . . . . . 0.404 HG11 ' O ' ' B' ' 218' ' ' ALA . 26.3 t -82.24 -41.84 18.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.44 -0.8 . . . . 63.43 110.092 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 13.3 p -62.3 -37.35 85.23 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.112 -0.494 . . . . 72.329999999999998 110.121 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.04 76.63 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.889 -0.596 . . . . 74.450000000000003 110.882 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 42.3 m -68.41 -35.65 77.97 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.855 0.359 . . . . 63.140000000000001 110.045 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.578 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.55 -38.01 83.51 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.294 -0.632 . . . . 75.040000000000006 109.294 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.75 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -62.13 -53.05 60.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.097 -0.956 . . . . 74.209999999999994 110.948 176.919 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -61.81 -38.67 89.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.125 -0.489 . . . . 74.109999999999999 111.114 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.653 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.37 -41.34 96.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.376 -0.374 . . . . 70.140000000000001 111.423 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.98 -34.39 78.31 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 120.666 0.27 . . . . 75.109999999999999 110.371 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.48 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -62.47 -39.14 92.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.367 -0.379 . . . . 74.209999999999994 111.104 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -73.3 -34.94 66.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.146 0.498 . . . . 65.129999999999995 110.339 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.408 ' CD1' ' HB3' ' A' ' 33' ' ' SER . 4.3 t80 -80.94 -30.4 35.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.604 -0.725 . . . . 74.349999999999994 110.585 -175.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -77.46 -40.59 42.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 72.120000000000005 110.824 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -62.35 -17.82 59.9 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.098 0.475 . . . . 72.519999999999996 111.274 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -59.32 -26.87 65.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.284 -0.871 . . . . 75.329999999999998 111.307 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.429 ' O ' HG22 ' B' ' 250' ' ' THR . 67.4 m-85 -89.6 1.36 56.09 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.373 -0.376 . . . . 72.219999999999999 111.511 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -63.72 -29.47 74.83 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.067 -1.063 . . . . 72.310000000000002 111.144 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 22.5 m -71.15 -6.97 43.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.102 0.408 . . . . 73.409999999999997 112.102 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 250' ' ' THR . . . . . 0.429 HG22 ' O ' ' B' ' 247' ' ' PHE . 12.8 t -115.6 16.99 16.46 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.0 0.429 . . . . 43.140000000000001 110.623 176.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.2 t -83.97 -59.16 2.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.346 -0.388 . . . . 62.299999999999997 110.876 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.723 ' CE2' ' HG2' ' B' ' 261' ' ' LYS . 1.6 m-85 -126.96 172.97 9.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.618 0.247 . . . . 71.519999999999996 111.006 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 7.8 pt-20 -94.1 -42.55 8.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.053 -0.522 . . . . 65.109999999999999 111.727 -173.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 50.7 p -100.16 154.12 18.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.508 -0.315 . . . . 71.540000000000006 110.39 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -65.1 -30.75 71.71 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.9 -0.32 . . . . 71.140000000000001 110.595 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -66.85 -45.93 76.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.014 0.435 . . . . 73.409999999999997 110.88 -178.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.568 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 96.3 mt-30 -80.19 -24.77 40.08 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.147 -0.479 . . . . 73.409999999999997 110.768 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.483 ' SD ' HG12 ' A' ' 85' ' ' ILE . 20.3 ttt -76.34 -39.24 54.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.459 . . . . 70.150000000000006 110.214 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.554 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.0 tt0 -67.8 -49.01 64.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.611 . . . . 71.409999999999997 111.651 -177.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.26 66.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.128 0.49 . . . . 74.310000000000002 110.641 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.723 ' HG2' ' CE2' ' B' ' 252' ' ' PHE . 13.6 mptt -95.89 8.67 42.98 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.47 -0.787 . . . . 33.549999999999997 111.487 -175.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.629 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 15.2 ptpt -52.82 -45.74 67.43 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.309 -0.626 . . . . 74.540000000000006 109.309 175.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.629 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 10.2 tp60 -75.0 -24.07 58.34 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.99 -0.55 . . . . 72.530000000000001 110.858 -175.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.25 -46.31 74.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.571 0.224 . . . . 74.340000000000003 110.936 178.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.51 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.7 ptt? -78.4 -33.21 48.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.279 -0.568 . . . . 64.200000000000003 109.736 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.623 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 45.8 mtp -83.13 21.65 1.06 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.796 -0.638 . . . . 64.040000000000006 111.0 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 267' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 34.7 t70 -109.45 -25.08 10.69 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.659 -0.497 . . . . 62.130000000000003 109.659 174.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.488 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 18.3 p90 -113.81 -20.62 11.05 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.423 -0.511 . . . . 70.140000000000001 111.651 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -54.63 -48.24 72.5 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.097 0.475 . . . . 73.25 110.388 177.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.595 ' HG2' ' OD1' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -53.88 -47.67 70.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.238 -0.892 . . . . 65.420000000000002 110.584 175.568 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 271' ' ' ASP . . . . . 0.482 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 5.4 t70 -78.89 7.11 7.68 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.485 -1.234 . . . . 74.549999999999997 111.801 -170.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 6.9 mtp180 -84.02 -26.42 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.918 -0.489 . . . . 71.25 111.669 -171.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.806 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -106.9 15.07 25.84 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.707 -0.397 . . . . 73.099999999999994 110.258 179.15 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.446 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 26.3 ttmt -60.78 -53.82 52.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.96 -0.563 . . . . 75.209999999999994 110.71 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -64.31 -36.4 84.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.966 0.412 . . . . 61.25 110.801 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.4 mtt -58.91 -43.75 91.12 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 74.319999999999993 110.031 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 1.3 tt -72.4 -39.1 68.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.303 -0.862 . . . . 71.230000000000004 109.753 -178.093 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 278' ' ' ASP . . . . . 0.434 ' N ' ' HE1' ' A' ' 66' ' ' MET . 20.6 t70 -62.19 -34.84 77.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.403 -0.817 . . . . 71.109999999999999 111.005 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -83.5 -6.94 59.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.594 -0.73 . . . . 74.129999999999995 111.913 -178.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -104.2 -3.77 23.95 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.571 -0.452 . . . . 75.409999999999997 111.24 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.447 ' HE3' ' CD2' ' B' ' 277' ' ' LEU . 42.0 mtt -89.82 -167.04 1.74 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.234 -0.439 . . . . 53.409999999999997 111.293 176.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.4 mt-10 70.29 -12.25 0.52 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.057 -0.974 . . . . 75.129999999999995 113.376 176.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -57.97 -57.76 11.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.051 0.453 . . . . 71.239999999999995 110.129 175.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -72.58 -16.24 61.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.043 -0.526 . . . . 65.510000000000005 111.475 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' B' ' 282' ' ' GLU . 56.1 mt -76.55 -56.98 6.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.488 -0.323 . . . . 64.340000000000003 110.234 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.3 pt-20 -62.18 -34.19 75.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 72.099999999999994 110.775 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -87.99 6.56 35.37 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.344 -0.389 . . . . 71.540000000000006 111.724 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.515 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 44.2 t80 -56.43 -47.76 78.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.321 -0.622 . . . . 64.420000000000002 109.321 174.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -59.59 -41.15 89.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.748 -0.66 . . . . 71.510000000000005 110.407 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -59.88 -54.52 45.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 75.120000000000005 110.349 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 291' ' ' TYR . . . . . 0.42 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 66.3 m-85 -62.53 -48.51 79.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.086 -0.506 . . . . 73.219999999999999 110.813 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.53 -19.61 57.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.036 -0.529 . . . . 73.049999999999997 111.16 -177.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.04 -37.02 13.7 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.973 -0.558 . . . . 74.319999999999993 110.889 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 38.5 p -75.32 -22.51 57.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 60.25 110.96 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 78.8 mt-30 -103.4 131.19 50.7 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.938 -0.574 . . . . 74.120000000000005 110.133 -177.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 296' ' ' LYS . . . . . 0.465 ' HD2' ' N ' ' B' ' 296' ' ' LYS . 9.9 mptt . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.355 -0.831 . . . . 74.120000000000005 109.097 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 110.022 -0.362 . . . . 61.409999999999997 110.022 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -78.18 -9.93 59.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.106 0.479 . . . . 72.409999999999997 111.016 -178.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.9 p-10 -99.84 149.7 23.11 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.9 -0.591 . . . . 51.32 109.81 176.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.598 ' HB3' ' HE2' ' A' ' 8' ' ' TYR . 37.5 tt0 -65.8 -81.12 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.19 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -124.14 -27.56 3.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.175 0.512 . . . . 73.120000000000005 110.24 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -106.38 167.86 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.004 -0.544 . . . . 61.549999999999997 111.329 -175.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -78.7 47.18 0.71 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.427 -0.806 . . . . 74.209999999999994 111.643 -178.956 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.598 ' HE2' ' HB3' ' A' ' 4' ' ' GLU . 75.2 m-85 -49.37 -48.54 46.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 71.439999999999998 111.591 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -26.27 67.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.041 -0.527 . . . . 23.199999999999999 112.2 -175.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 10' ' ' ARG . 27.1 mmt180 -81.39 -51.49 8.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.269 -0.172 . . . . 71.109999999999999 111.404 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.656 ' HB1' ' HB2' ' B' ' 239' ' ' ALA . . . -63.6 -23.5 67.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.874 0.845 . . . . 70.439999999999998 109.701 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -58.63 -33.47 70.08 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.124 -1.398 . . . . 72.310000000000002 111.22 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.593 ' HB2' HD11 ' B' ' 217' ' ' LEU . 28.1 mt-10 -79.15 -31.9 44.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.374 0.607 . . . . 75.409999999999997 109.469 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.634 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -63.01 -43.46 98.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.019 -0.991 . . . . 75.25 109.533 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.68 HG23 ' HD2' ' B' ' 243' ' ' TYR . 84.9 mt -69.91 -33.09 54.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.348 -0.842 . . . . 72.450000000000003 110.598 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -31.14 71.19 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.9 -0.591 . . . . 74.530000000000001 111.055 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.548 HD12 HD22 ' B' ' 214' ' ' LEU . 2.8 tm? -69.71 -45.92 67.12 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.05 -0.722 . . . . 72.329999999999998 109.05 176.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.77 -39.27 84.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.968 -0.56 . . . . 71.209999999999994 110.808 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.91 -21.47 66.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.281 -0.418 . . . . 72.430000000000007 111.396 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -80.79 -33.95 34.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.012 0.435 . . . . 72.5 109.865 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -78.69 -24.3 45.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.245 0.545 . . . . 75.430000000000007 110.025 177.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.492 ' OD1' HG23 ' A' ' 29' ' ' THR . 0.2 OUTLIER -70.49 -10.91 60.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.49 -0.777 . . . . 65.530000000000001 109.577 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -78.83 -9.75 59.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.584 -0.734 . . . . 75.120000000000005 110.737 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.43 159.64 33.84 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.154 0.502 . . . . 64.340000000000003 110.977 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.6 t -121.37 -16.57 7.84 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.469 -0.787 . . . . 72.099999999999994 110.239 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.74 3.71 49.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.515 -0.766 . . . . 74.0 111.021 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.726 HG22 ' H ' ' A' ' 28' ' ' GLN . 1.6 mt -128.25 -174.72 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.129999999999995 109.742 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.843 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 41.5 mt-30 -120.4 160.57 22.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.389 -0.597 . . . . 45.229999999999997 109.389 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.519 HG22 ' HZ ' ' B' ' 247' ' ' PHE . 58.6 m -64.01 -38.56 91.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.024 0.44 . . . . 73.450000000000003 110.802 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.56 74.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.086 -0.578 . . . . 71.450000000000003 112.979 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.843 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 8.5 mm-40 -68.99 -35.76 77.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.312 0.577 . . . . 64.329999999999998 109.596 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.41 HG21 ' HA ' ' A' ' 22' ' ' ASN . 47.8 t -63.84 -43.97 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.176 -0.92 . . . . 71.400000000000006 109.819 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.1 t -61.08 -42.93 99.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.719 -0.673 . . . . 73.400000000000006 110.438 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.888 -0.596 . . . . 61.340000000000003 111.279 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.518 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 16.2 m -66.71 -33.13 74.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.775 -0.454 . . . . 71.120000000000005 109.775 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.647 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.0 t80 -67.11 -41.09 86.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.3 0.572 . . . . 72.230000000000004 109.538 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.72 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.0 ttm -64.65 -48.47 74.7 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.51 -0.768 . . . . 75.120000000000005 111.427 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.517 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 27.4 t-105 -64.21 -37.15 86.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.387 . . . . 74.340000000000003 110.916 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.581 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -65.44 -36.38 83.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.962 0.41 . . . . 33.539999999999999 110.657 178.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.756 HD21 ' SD ' ' B' ' 237' ' ' MET . 58.6 tp -68.52 -36.96 79.58 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 74.420000000000002 109.703 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -33.25 71.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.644 -0.707 . . . . 65.310000000000002 111.076 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -78.5 -52.51 8.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.13 -0.486 . . . . 74.120000000000005 110.733 178.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.445 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 20.2 t80 -65.42 -42.28 92.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.39 -0.823 . . . . 74.230000000000004 111.549 -173.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -80.24 -25.14 39.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.405 -0.362 . . . . 64.310000000000002 111.652 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.616 ' HB2' ' HG ' ' B' ' 277' ' ' LEU . . . -81.28 -21.03 39.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.081 0.467 . . . . 74.120000000000005 110.54 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.445 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 11.3 t90 -56.63 -32.92 65.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 71.129999999999995 110.553 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -72.51 -9.0 58.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 71.200000000000003 111.532 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.79 -30.92 74.86 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.468 -0.872 . . . . 70.129999999999995 111.066 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 t -71.62 -2.96 18.99 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.747 0.308 . . . . 43.140000000000001 111.212 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -127.25 16.18 7.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.194 0.521 . . . . 53.340000000000003 109.978 174.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.5 t -74.17 -47.9 32.74 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.943 -0.571 . . . . 70.129999999999995 111.203 -175.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.643 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -134.03 -176.09 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.126 0.489 . . . . 74.209999999999994 112.078 -176.48 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.643 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.2 pt-20 -97.63 -25.59 15.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.133 -0.939 . . . . 75.510000000000005 111.881 -171.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.536 ' HA ' ' CE2' ' B' ' 288' ' ' PHE . 67.7 p -135.92 157.76 46.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.199 -0.455 . . . . 73.109999999999999 109.785 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.561 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 9.8 ptmm? -71.64 -30.59 65.93 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.547 -0.461 . . . . 72.040000000000006 110.322 -177.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.74 -38.78 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 61.200000000000003 110.414 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.697 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 97.9 mt-30 -88.05 -38.14 15.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.74 -0.664 . . . . 63.219999999999999 110.265 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.5 ttt -60.07 -40.86 91.01 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.144 0.497 . . . . 72.519999999999996 111.182 178.084 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -63.37 -31.39 72.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.607 -0.724 . . . . 62.240000000000002 110.823 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.78 1.89 47.79 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.044 -0.525 . . . . 64.310000000000002 111.07 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -111.9 -0.99 15.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.092 -0.504 . . . . 71.230000000000004 109.715 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 8.3 ttmm -51.39 -62.7 1.46 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.413 -0.812 . . . . 72.530000000000001 110.285 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -75.64 -11.92 60.1 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.548 -0.751 . . . . 63.210000000000001 110.471 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.42 -49.89 17.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.668 . . . . 73.120000000000005 110.767 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.507 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.2 ptt? -79.76 -26.7 40.61 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.253 0.549 . . . . 75.430000000000007 109.846 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.444 ' HG2' HD22 ' B' ' 277' ' ' LEU . 92.4 mtp -79.14 -2.12 39.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.641 -0.709 . . . . 72.129999999999995 110.522 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -74.47 -27.57 60.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.418 -0.956 . . . . 61.299999999999997 108.418 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.462 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 26.5 m-85 -102.82 -30.12 11.04 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.111 -1.404 . . . . 75.349999999999994 111.995 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -56.28 -58.31 8.52 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.011 -0.737 . . . . 73.219999999999999 109.011 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.523 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -56.9 -59.53 4.9 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.499 -0.318 . . . . 75.120000000000005 110.992 173.31 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -107.42 75.59 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.703 0.631 . . . . 73.129999999999995 112.703 -170.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.462 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 2.1 mmm180 -140.52 -29.95 0.67 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.841 -0.618 . . . . 74.340000000000003 110.323 166.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.05 7.42 24.69 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.727 -0.842 . . . . 71.200000000000003 108.727 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -59.59 -60.22 4.19 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.732 -1.122 . . . . 62.109999999999999 110.417 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.31 -32.39 73.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.89 -0.595 . . . . 73.010000000000005 111.517 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.465 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 53.0 mtt -59.76 -48.92 79.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.556 0.693 . . . . 72.109999999999999 109.321 172.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.737 HD21 ' HD2' ' B' ' 269' ' ' TYR . 17.6 tp -63.32 -38.27 90.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.416 -1.266 . . . . 74.120000000000005 110.628 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.406 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -63.19 -53.93 45.48 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.771 -0.65 . . . . 64.129999999999995 110.199 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.12 -12.92 61.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.064 -0.971 . . . . 65.219999999999999 111.604 -178.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.0 -10.26 39.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.383 -0.371 . . . . 64.310000000000002 110.939 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.46 ' O ' HG13 ' A' ' 85' ' ' ILE . 63.4 mtt -101.12 -55.28 2.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 72.209999999999994 111.246 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.582 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 11.5 pt-20 -68.64 -14.89 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.852 0.686 . . . . 73.450000000000003 112.852 -169.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.09 -33.27 70.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.445 -0.576 . . . . 62.200000000000003 109.445 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -77.23 -38.41 51.28 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.859 -0.61 . . . . 75.340000000000003 110.215 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.647 HD13 ' HA ' ' B' ' 259' ' ' GLN . 68.1 mt -59.22 -54.84 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.854 -0.612 . . . . 72.409999999999997 110.932 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.829 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 8.4 pt-20 -58.82 -33.87 70.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.454 -0.339 . . . . 70.310000000000002 111.559 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -94.24 17.51 12.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.681 -0.236 . . . . 64.519999999999996 111.497 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.494 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 22.2 t80 -53.14 -51.69 61.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.707 -0.224 . . . . 74.409999999999997 110.996 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -59.85 -28.7 67.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.246 -0.434 . . . . 75.140000000000001 111.27 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -71.67 -53.25 14.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.98 0.419 . . . . 73.230000000000004 110.01 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.499 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 75.0 m-85 -64.17 -35.43 80.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.228 -0.442 . . . . 63.109999999999999 110.833 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.418 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 0.3 OUTLIER -70.45 -8.22 49.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.593 0.711 . . . . 74.530000000000001 110.511 178.408 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -98.9 -26.78 14.17 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.957 -0.565 . . . . 62.420000000000002 110.583 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 46.8 p -84.92 -30.25 24.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.101 -0.499 . . . . 62.210000000000001 110.888 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 0.2 OUTLIER -119.14 155.66 31.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.946 0.403 . . . . 64.040000000000006 110.286 178.132 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.47 ' NZ ' ' HB2' ' A' ' 96' ' ' LYS . 9.5 mtmp? . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 115.827 -0.624 . . . . 73.030000000000001 110.735 -175.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 120.754 0.311 . . . . 55.100000000000001 110.541 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -69.86 -21.93 63.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.107 0.48 . . . . 74.400000000000006 110.777 178.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.3 p-10 -154.96 136.28 14.06 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.053 -0.721 . . . . 74.430000000000007 109.053 173.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.46 -92.51 0.12 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.88 0.371 . . . . 73.519999999999996 110.975 -176.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -95.4 -28.75 14.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.437 0.637 . . . . 71.099999999999994 109.483 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -103.87 160.58 14.68 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.26 -0.882 . . . . 70.409999999999997 110.882 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.518 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -82.06 48.34 1.23 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.978 -1.01 . . . . 63.119999999999997 111.617 -177.641 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.517 ' HD2' ' HA ' ' B' ' 203' ' ' ASN . 53.7 m-85 -46.98 -53.55 12.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.242 -0.435 . . . . 75.099999999999994 111.921 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 209' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -58.88 -36.4 74.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.897 -0.592 . . . . 61.119999999999997 112.247 -176.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.483 ' O ' HD23 ' B' ' 214' ' ' LEU . 35.7 mmt180 -71.63 -48.94 44.58 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 111.75 0.278 . . . . 61.240000000000002 111.75 -176.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 39' ' ' ALA . . . -63.88 -26.54 68.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.951 0.882 . . . . 75.430000000000007 109.585 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 212' ' ' THR . . . . . 0.416 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 3.1 m -62.54 -32.73 73.73 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.254 -1.339 . . . . 70.109999999999999 111.611 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 32.8 mt-10 -75.35 -28.75 59.71 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.553 0.692 . . . . 72.450000000000003 109.247 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.647 HD12 ' CD1' ' A' ' 36' ' ' PHE . 3.4 mm? -65.37 -44.39 87.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.996 -1.002 . . . . 75.329999999999998 109.578 176.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.435 HG23 ' HD2' ' A' ' 43' ' ' TYR . 75.2 mt -69.15 -27.93 36.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.441 -0.799 . . . . 73.150000000000006 110.389 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 14.2 tmtt? -60.15 -35.09 74.53 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.079 -0.51 . . . . 61.219999999999999 110.931 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.0 tm? -69.77 -42.25 74.07 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.968 -0.753 . . . . 74.129999999999995 108.968 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.33 84.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.84 -0.618 . . . . 74.010000000000005 110.797 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 93.6 m-20 -60.61 -26.11 66.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 72.219999999999999 111.165 179.111 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -31.85 43.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.594 -0.276 . . . . 72.439999999999998 111.2 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -80.69 -28.06 36.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.479 0.656 . . . . 71.109999999999999 110.594 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 67.3 t30 -75.44 -1.47 24.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.185 -0.916 . . . . 71.120000000000005 110.672 -178.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.9 mm-40 -79.28 -0.56 32.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.06 -0.518 . . . . 73.310000000000002 111.613 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.478 ' OD1' HG13 ' B' ' 227' ' ' ILE . 1.8 t-20 -80.06 164.9 23.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.015 0.436 . . . . 63.210000000000001 110.49 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 1.5 t -96.18 -40.11 9.35 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.82 -0.627 . . . . 50.329999999999998 112.468 -173.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.16 3.18 43.64 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 112.91 0.707 . . . . 75.239999999999995 112.91 -175.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.478 HG13 ' OD1' ' B' ' 224' ' ' ASN . 12.7 mt -94.88 147.41 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 C-N-CA 120.192 -0.603 . . . . 71.420000000000002 109.565 175.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.577 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 37.2 mt-30 -84.01 147.37 27.46 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.569 -0.741 . . . . 73.409999999999997 109.365 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 7.8 m -57.3 -27.43 62.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.277 0.561 . . . . 54.140000000000001 110.282 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -76.65 -21.16 75.4 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.577 -0.738 . . . . 60.350000000000001 113.41 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.577 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 12.4 mm-40 -72.29 -30.98 65.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.64 0.72 . . . . 60.25 110.088 -176.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.3 t -69.73 -39.85 78.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.293 -0.867 . . . . 72.209999999999994 109.502 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.9 t -62.56 -38.49 90.29 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.78 -0.645 . . . . 61.140000000000001 109.744 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.27 -36.33 82.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.949 -0.568 . . . . 71.420000000000002 110.796 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.475 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.2 m -66.44 -35.21 79.74 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.686 -0.487 . . . . 73.129999999999995 109.686 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.558 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.0 t80 -66.96 -37.57 84.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.774 -0.648 . . . . 74.549999999999997 109.655 176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.756 ' SD ' HD21 ' A' ' 40' ' ' LEU . 8.6 tpt -63.64 -52.45 60.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 75.340000000000003 110.729 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.465 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 22.3 t-105 -63.48 -38.41 91.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.96 -0.564 . . . . 74.409999999999997 111.332 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.656 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -65.72 -31.85 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.547 -0.297 . . . . 60.409999999999997 111.392 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' B' ' 244' ' ' ASN . 44.4 tp -64.85 -38.52 91.27 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.864 -0.421 . . . . 62.109999999999999 109.864 177.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.543 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 71.209999999999994 110.312 177.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 242' ' ' ARG . . . . . 0.409 ' HA ' ' NE ' ' B' ' 242' ' ' ARG . 1.0 OUTLIER -58.68 -48.86 79.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 75.219999999999999 111.53 178.022 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.68 ' HD2' HG23 ' A' ' 15' ' ' ILE . 11.3 t80 -75.33 -36.85 60.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.968 -0.56 . . . . 73.340000000000003 111.494 -173.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 244' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' B' ' 240' ' ' LEU . 9.0 t-20 -74.88 -40.52 60.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.835 0.35 . . . . 74.109999999999999 111.266 -176.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.426 ' HB2' HD12 ' A' ' 77' ' ' LEU . . . -66.82 -22.47 66.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.932 0.396 . . . . 62.229999999999997 111.272 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 246' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' B' ' 243' ' ' TYR . 13.2 t90 -57.56 -31.81 66.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.606 -0.724 . . . . 63.340000000000003 110.565 175.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.519 ' HZ ' HG22 ' A' ' 29' ' ' THR . 71.3 m-85 -74.79 -11.03 60.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.238 -0.437 . . . . 73.019999999999996 111.526 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -70.13 -31.35 69.27 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.477 -0.868 . . . . 55.340000000000003 111.186 175.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.86 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 22.6 t -74.15 -7.84 54.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.807 0.337 . . . . 70.349999999999994 110.942 -176.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -120.86 21.59 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.354 0.597 . . . . 71.219999999999999 109.613 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 7.2 t -91.0 -38.69 12.66 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.691 -0.686 . . . . 62.200000000000003 111.289 -175.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.617 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -138.0 -170.07 2.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.204 0.526 . . . . 75.519999999999996 111.955 -176.888 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' B' ' 254' ' ' THR . 14.7 pt-20 -100.38 -49.82 4.12 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.349 -0.842 . . . . 73.329999999999998 111.237 -176.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.414 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 70.4 p -111.28 155.98 22.2 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.521 -0.309 . . . . 42.329999999999998 110.391 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.829 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 5.9 ptmm? -68.29 -27.26 66.16 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.812 -0.355 . . . . 62.32 110.588 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.25 -53.86 53.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.135 0.493 . . . . 71.319999999999993 110.327 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.692 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 81.7 mt-30 -79.1 -36.01 41.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.717 -0.674 . . . . 73.310000000000002 110.372 -177.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.86 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 20.4 ttt -61.9 -40.04 94.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.747 -0.661 . . . . 53.149999999999999 111.047 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.647 ' HA ' HD13 ' A' ' 85' ' ' ILE . 4.8 tp-100 -59.98 -41.57 92.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.957 -0.565 . . . . 70.109999999999999 110.823 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.99 -17.29 62.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.777 -0.647 . . . . 71.310000000000002 111.064 -178.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.692 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.3 mmmt -91.58 -18.16 24.5 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 116.118 -0.492 . . . . 72.230000000000004 110.523 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 262' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -48.41 -61.64 1.91 Allowed 'General case' 0 N--CA 1.443 -0.818 0 O-C-N 123.709 0.63 . . . . 53.409999999999997 110.439 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.01 -26.02 65.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.004 -0.544 . . . . 73.129999999999995 111.021 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -74.26 -35.94 63.81 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.988 -0.285 . . . . 75.219999999999999 111.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 19.0 ptp -83.65 -25.32 30.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.104 -0.702 . . . . 61.409999999999997 109.104 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.406 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 58.9 mtp -80.7 -24.67 38.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.16 -0.927 . . . . 73.409999999999997 111.784 179.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.18 -35.69 71.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.909 0.385 . . . . 62.43 111.93 -168.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.59 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 25.2 p90 -103.33 -3.41 25.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.291 -0.413 . . . . 70.140000000000001 110.903 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.737 ' HD2' HD21 ' A' ' 77' ' ' LEU . 2.1 m-30 -65.84 -42.72 90.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.452 0.168 . . . . 75.409999999999997 111.115 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 270' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -44.62 83.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.538 0.685 . . . . 74.200000000000003 109.577 174.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -86.06 17.39 3.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.98 -1.009 . . . . 73.349999999999994 111.621 -172.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.59 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 2.0 mmm180 -89.61 -47.88 7.67 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.501 -0.749 . . . . 64.450000000000003 110.94 -174.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.72 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.22 12.23 33.63 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.099 0.476 . . . . 72.239999999999995 109.796 -176.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -58.43 -57.98 10.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.41 -0.814 . . . . 63.229999999999997 110.341 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -60.76 -37.99 83.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.723 -0.671 . . . . 64.200000000000003 111.111 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 48.9 mtt -59.59 -45.55 91.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.433 0.635 . . . . 55.329999999999998 110.092 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.616 ' HG ' ' HB2' ' A' ' 45' ' ' ALA . 6.3 tt -71.56 -42.1 68.26 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.175 -0.92 . . . . 71.329999999999998 110.413 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -56.8 -41.98 78.68 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.468 0.651 . . . . 71.450000000000003 110.301 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.06 -13.32 62.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.902 -1.044 . . . . 73.129999999999995 112.189 -177.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -98.9 -7.95 26.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.987 0.422 . . . . 75.209999999999994 110.391 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.523 ' HG3' ' HB1' ' A' ' 45' ' ' ALA . 55.1 mtt -94.19 -50.77 5.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.221 -0.445 . . . . 74.019999999999996 111.08 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 0.0 OUTLIER -57.13 -25.8 59.45 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.49 -0.777 . . . . 72.219999999999999 111.968 -173.843 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.56 -42.57 92.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.055 -0.52 . . . . 64.019999999999996 110.448 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -82.36 -34.47 28.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 71.450000000000003 110.516 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.448 HG13 ' O ' ' B' ' 281' ' ' MET . 69.0 mt -58.22 -58.02 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 116.228 -0.442 . . . . 74.109999999999999 111.677 -177.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.0 pt-20 -64.49 -29.06 70.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.34 -0.391 . . . . 74.120000000000005 111.346 -175.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -100.04 12.45 36.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.721 -0.218 . . . . 64.530000000000001 111.342 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.561 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 78.3 t80 -55.31 -56.94 14.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.727 -0.215 . . . . 60.520000000000003 111.19 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.98 -21.69 66.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.82 0.343 . . . . 71.329999999999998 110.598 -176.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -66.33 -52.99 41.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.425 -0.583 . . . . 65.010000000000005 109.425 175.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -66.87 -38.21 85.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.332 0.587 . . . . 73.209999999999994 110.334 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.455 ' HA ' ' HG2' ' B' ' 295' ' ' GLN . 3.7 tmm_? -67.29 -17.69 64.88 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.131 -0.941 . . . . 73.450000000000003 110.284 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.6 -25.74 19.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 75.420000000000002 111.032 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 32.7 p -91.92 -18.71 23.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.322 -0.399 . . . . 55.229999999999997 111.153 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.455 ' HG2' ' HA ' ' B' ' 292' ' ' ARG . 18.5 pt20 -80.83 142.78 33.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.483 0.659 . . . . 73.109999999999999 110.614 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 50.3 mttp . . . . . 0 C--O 1.247 0.972 0 CA-C-N 115.185 -0.916 . . . . 74.200000000000003 108.949 178.369 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.4 t . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 120.61 0.243 . . . . 73.329999999999998 110.497 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -81.51 148.61 29.1 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.071 -0.344 . . . . 63.200000000000003 110.071 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.7 p-10 -77.9 136.83 38.09 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.483 -0.562 . . . . 62.32 109.483 175.547 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -67.99 -83.4 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.438 . . . . 75.109999999999999 111.0 -176.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -111.9 -42.16 3.85 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.854 -0.612 . . . . 71.409999999999997 109.511 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.709 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -93.45 154.02 18.16 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.859 -0.61 . . . . 75.400000000000006 110.097 174.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.452 ' HB2' ' HD2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -78.36 51.91 1.08 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.602 -0.726 . . . . 74.109999999999999 112.478 -177.333 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -51.91 -46.95 64.81 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.847 0.356 . . . . 72.019999999999996 111.46 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.2 -6.07 36.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.913 -0.585 . . . . 75.430000000000007 112.359 -173.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 84.7 mtt180 -100.11 -60.71 1.48 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.926 -0.398 . . . . 73.230000000000004 109.926 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.27 -25.65 24.63 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.594 0.59 . . . . 52.530000000000001 112.594 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.9 t -62.13 -26.53 68.37 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.743 -0.208 . . . . 73.049999999999997 111.362 -178.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.565 ' HB2' HD11 ' B' ' 217' ' ' LEU . 26.5 mt-10 -84.39 -25.14 29.3 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.354 0.597 . . . . 75.25 109.705 -178.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.74 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -68.56 -49.53 58.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.31 -0.859 . . . . 71.5 109.203 177.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.525 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.2 mt -64.91 -29.28 46.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.643 -0.708 . . . . 71.340000000000003 109.807 175.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 12' ' ' THR . 2.4 tmmt? -62.5 -38.0 88.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.804 -0.634 . . . . 74.219999999999999 111.085 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.5 HD12 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -65.92 -47.42 74.83 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.873 -0.788 . . . . 54.039999999999999 108.873 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.59 -35.85 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.39 -0.823 . . . . 70.129999999999995 110.969 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.627 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 5.1 m-80 -58.94 -34.5 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 75.109999999999999 111.347 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.0 -41.58 67.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.242 -0.435 . . . . 72.230000000000004 111.271 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -74.11 -20.51 60.23 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.346 0.593 . . . . 73.140000000000001 109.909 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -83.51 -4.91 58.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.302 -0.863 . . . . 74.439999999999998 110.751 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.627 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 88.9 mt-30 -82.54 17.83 1.67 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.396 -0.365 . . . . 72.450000000000003 111.162 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.454 HD21 ' HA ' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -105.33 156.96 17.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.759 0.314 . . . . 72.400000000000006 110.616 -177.338 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 t -100.63 -37.02 8.94 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.837 0.68 . . . . 72.439999999999998 112.837 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.8 pm0 -85.23 -2.44 58.05 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.752 -0.379 . . . . 72.420000000000002 110.951 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.407 HG22 ' O ' ' A' ' 28' ' ' GLN . 8.6 mt -96.91 145.44 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.526 0.679 . . . . 64.340000000000003 110.252 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.653 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 65.6 mt-30 -79.66 140.71 36.97 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.716 -1.129 . . . . 65.420000000000002 108.105 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.4 m -58.38 -24.83 61.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.987 0.422 . . . . 72.209999999999994 111.06 -176.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -82.17 -11.73 81.9 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.868 -0.605 . . . . 73.049999999999997 113.833 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.653 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 50.2 mt-10 -70.21 -31.31 68.68 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 117.97 0.885 . . . . 70.450000000000003 110.286 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 19.0 t -79.45 -32.76 14.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.642 -0.708 . . . . 64.109999999999999 109.901 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.66 -42.57 98.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.608 -0.723 . . . . 72.310000000000002 110.202 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.04 -36.22 81.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.624 -0.716 . . . . 73.540000000000006 111.177 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.452 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 3.6 p -71.96 -27.71 62.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.349999999999994 110.458 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.593 ' CD1' HD12 ' B' ' 214' ' ' LEU . 11.4 t80 -69.6 -37.57 76.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.415 -0.587 . . . . 72.209999999999994 109.415 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.751 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 12.1 ttt -72.73 -49.85 28.4 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.892 -0.595 . . . . 74.140000000000001 111.104 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -52.4 -41.66 63.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.497 -0.774 . . . . 75.549999999999997 110.831 174.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.542 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.97 -33.78 76.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 63.130000000000003 111.348 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.562 HD21 ' HG3' ' B' ' 237' ' ' MET . 58.3 tp -65.65 -35.64 81.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.024 0.44 . . . . 71.019999999999996 110.136 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.446 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -63.4 -44.26 95.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.783 -0.644 . . . . 72.400000000000006 110.715 178.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -67.21 -24.12 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.215 -0.448 . . . . 61.439999999999998 110.99 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.411 ' HD1' HG23 ' B' ' 215' ' ' ILE . 3.1 t80 -90.02 -47.43 7.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.29 -0.414 . . . . 65.120000000000005 110.836 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -65.44 -26.04 67.79 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.1 0.407 . . . . 73.129999999999995 112.1 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.43 -14.53 62.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.787 0.327 . . . . 65.219999999999999 111.259 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -61.58 -31.92 72.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 75.049999999999997 110.342 176.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.882 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 55.0 m-85 -70.65 -12.99 61.9 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.173 -0.467 . . . . 71.420000000000002 111.226 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.505 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -65.54 -32.63 83.91 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.22 -0.991 . . . . 52.340000000000003 110.643 173.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.903 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 15.3 m -78.23 -9.57 59.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.009 0.433 . . . . 30.52 110.857 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 63.2 p -106.71 -3.1 20.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.184 0.516 . . . . 55.310000000000002 110.324 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.1 t -72.84 -43.37 62.73 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.67 -0.696 . . . . 75.030000000000001 110.522 -175.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.47 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 11.0 m-85 -149.72 178.1 9.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.921 -0.582 . . . . 71.140000000000001 110.596 -177.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.6 pt-20 -98.61 -52.65 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.059 -0.519 . . . . 60.130000000000003 111.129 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.425 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.6 p -88.01 148.59 24.45 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 116.596 -0.275 . . . . 72.430000000000007 110.523 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.427 ' HB2' ' HE2' ' A' ' 55' ' ' LYS . 7.8 ptmm? -66.28 -25.34 66.82 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.869 -0.332 . . . . 75.109999999999999 110.62 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -64.59 -41.65 96.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.437 . . . . 71.510000000000005 110.613 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.725 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 91.3 mt-30 -85.93 -37.99 18.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.996 -0.547 . . . . 71.349999999999994 109.806 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.903 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.6 ttt -63.88 -43.43 96.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.586 -0.734 . . . . 63.329999999999998 111.618 -177.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.575 ' HA ' HD13 ' B' ' 285' ' ' ILE . 42.9 tt0 -68.86 -34.92 76.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.36 -0.382 . . . . 75.530000000000001 111.154 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.07 2.56 10.35 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.205 -0.452 . . . . 73.140000000000001 111.613 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.725 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.6 mmmt -113.52 -2.44 13.87 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 110.092 -0.336 . . . . 63.130000000000003 110.092 -177.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 0.2 OUTLIER -49.74 -57.9 6.38 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 123.721 0.638 . . . . 75.420000000000002 110.889 -175.319 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -80.07 -20.96 43.98 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 110.254 -0.276 . . . . 74.239999999999995 110.254 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -73.53 -39.61 64.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 63.420000000000002 111.866 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.5 ptt? -84.32 -19.12 34.24 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 119.9 -0.72 . . . . 60.299999999999997 109.483 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.402 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 46.0 mtp -85.35 -21.85 28.72 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.276 -0.874 . . . . 73.019999999999996 111.35 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.114 0.483 . . . . 53.299999999999997 111.072 -171.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.595 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.6 p90 -96.99 -8.12 31.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.863 -0.608 . . . . 75.239999999999995 111.073 -178.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.524 ' HD2' HD21 ' B' ' 277' ' ' LEU . 2.6 m-30 -61.4 -40.16 93.38 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 120.576 0.227 . . . . 72.349999999999994 111.009 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.617 ' SD ' ' HE3' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -55.69 -50.75 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.323 0.582 . . . . 73.109999999999999 110.224 174.795 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.539 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 1.9 t70 -88.02 27.45 1.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.238 -0.892 . . . . 71.200000000000003 111.467 -170.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 17.3 mmm180 -91.95 -54.45 3.85 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.17 -0.331 . . . . 61.439999999999998 111.317 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.748 ' HB3' ' HG2' ' B' ' 237' ' ' MET . 0.1 OUTLIER -79.33 5.62 12.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.181 0.515 . . . . 71.209999999999994 110.527 -177.372 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.74 -45.93 92.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.501 -0.772 . . . . 73.400000000000006 110.684 -179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.51 -33.11 74.96 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.726 -0.67 . . . . 72.349999999999994 111.097 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -69.2 -41.1 77.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.341 0.591 . . . . 64.530000000000001 109.951 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.49 ' HB3' ' CE ' ' B' ' 266' ' ' MET . 0.7 OUTLIER -65.36 -38.84 91.26 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.906 -1.043 . . . . 74.230000000000004 111.423 -174.539 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.445 ' N ' ' HE1' ' B' ' 266' ' ' MET . 28.8 t70 -65.21 -33.56 76.29 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.1 0.476 . . . . 52.119999999999997 110.795 -178.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.96 -14.84 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.895 -0.593 . . . . 73.349999999999994 110.753 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -92.22 -20.39 21.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.555 . . . . 71.439999999999998 110.383 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.44 ' C ' ' H ' ' A' ' 83' ' ' ASP . 24.0 mmt -77.2 -168.26 1.07 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.935 -0.575 . . . . 54.340000000000003 110.936 177.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 1.051 ' HA ' HD12 ' A' ' 85' ' ' ILE . 48.6 mt-10 66.98 -7.69 0.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.994 -1.003 . . . . 72.129999999999995 112.201 -178.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.468 ' O ' HG13 ' A' ' 85' ' ' ILE . 41.8 t0 -79.15 150.61 31.67 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.732 -0.84 . . . . 75.510000000000005 108.732 172.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.467 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 3.1 m-85 73.13 -40.92 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.589 1.155 . . . . 73.319999999999993 110.672 -172.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 1.051 HD12 ' HA ' ' A' ' 82' ' ' GLU . 7.4 mt -56.72 -57.63 8.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.269 -0.878 . . . . 73.319999999999993 111.131 177.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -57.75 -26.54 61.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.172 -0.922 . . . . 70.319999999999993 111.356 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.407 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 26.9 m120 -100.43 2.82 42.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.409999999999997 111.47 -175.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.551 ' O ' ' HB2' ' A' ' 92' ' ' ARG . 59.3 t80 -58.72 -48.22 81.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 72.329999999999998 110.452 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.77 -31.74 73.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.079 -0.51 . . . . 74.329999999999998 110.334 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' HB3' ' O ' ' A' ' 87' ' ' ASN . 6.2 t60 -63.12 -55.91 21.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.783 -0.644 . . . . 73.140000000000001 110.013 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -64.04 -43.43 95.56 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 74.129999999999995 110.703 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.551 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -63.26 -20.17 65.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.806 -0.634 . . . . 63.399999999999999 111.307 -179.019 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -88.78 -35.35 16.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.122 -0.49 . . . . 64.510000000000005 110.791 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.2 p -80.73 -34.16 34.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.089 -0.505 . . . . 62.420000000000002 111.46 -178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -75.72 153.03 37.33 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.931 0.396 . . . . 51.039999999999999 110.176 -178.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 57.2 mttp . . . . . 0 C--N 1.321 -0.653 0 CA-C-N 116.094 -0.503 . . . . 63.210000000000001 110.594 -175.014 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 201' ' ' SER . . . . . 0.42 ' HA ' ' CB ' ' B' ' 209' ' ' ALA . 32.0 t . . . . . 0 C--O 1.234 0.264 0 CA-C-O 121.133 0.492 . . . . 72.519999999999996 110.191 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -94.85 104.97 16.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.121 -0.49 . . . . 74.439999999999998 110.251 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -90.97 154.69 19.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 72.439999999999998 111.056 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.62 -86.51 0.15 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.997 -0.547 . . . . 63.149999999999999 110.321 173.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -111.6 -24.83 9.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.063 0.459 . . . . 62.119999999999997 110.546 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -94.76 -160.41 0.78 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.942 -0.572 . . . . 63.240000000000002 111.608 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.452 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -127.29 44.47 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.649 -0.705 . . . . 72.400000000000006 110.907 -176.575 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -52.89 -49.11 66.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.936 -0.575 . . . . 74.439999999999998 111.927 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 209' ' ' ALA . . . . . 0.42 ' CB ' ' HA ' ' B' ' 201' ' ' SER . . . -58.99 -25.57 63.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.82 -0.627 . . . . 65.329999999999998 112.027 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -82.64 -60.64 2.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 110.184 -0.302 . . . . 73.519999999999996 110.184 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.602 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -56.69 -27.29 58.6 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.872 0.693 . . . . 72.230000000000004 112.872 -176.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.1 t -68.59 -20.16 64.5 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.851 0.358 . . . . 73.230000000000004 110.976 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -80.81 -31.5 35.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.479 0.657 . . . . 75.150000000000006 109.283 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -66.4 -50.58 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.867 -1.06 . . . . 72.200000000000003 110.017 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.542 HG13 ' HB1' ' A' ' 39' ' ' ALA . 75.0 mt -63.82 -32.05 55.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.878 -0.601 . . . . 71.510000000000005 110.373 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -60.11 -34.09 73.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.462 -0.79 . . . . 71.439999999999998 110.985 -177.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.649 HD12 HD13 ' A' ' 14' ' ' LEU . 3.3 tm? -69.7 -40.42 76.34 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.288 -0.634 . . . . 64.310000000000002 109.288 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -63.06 -31.83 73.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.014 -0.539 . . . . 73.310000000000002 110.674 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.74 -31.62 72.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 73.230000000000004 110.76 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.11 -18.05 53.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.114 -0.494 . . . . 63.130000000000003 111.131 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 221' ' ' GLN . . . . . 0.408 ' OE1' HD21 ' A' ' 14' ' ' LEU . 70.5 mt-30 -92.38 -25.04 18.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.232 0.539 . . . . 62.509999999999998 110.021 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -79.14 4.46 14.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.753 -0.658 . . . . 65.239999999999995 109.968 177.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -73.47 -10.68 59.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.012 -0.736 . . . . 75.109999999999999 109.012 172.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -77.78 134.87 37.95 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.078 -0.964 . . . . 62.43 110.855 175.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.5 t -115.35 -15.63 11.54 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.397 -0.819 . . . . 73.040000000000006 108.823 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 226' ' ' GLU . . . . . 0.442 ' H ' ' CD ' ' B' ' 226' ' ' GLU . 1.6 pm0 -76.52 -22.76 53.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.969 -1.014 . . . . 75.510000000000005 110.423 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.406 HG22 ' N ' ' B' ' 228' ' ' GLN . 10.0 mt -98.29 156.37 3.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.269 -0.423 . . . . 73.319999999999993 109.941 177.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.546 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 73.4 mt-30 -76.01 138.88 41.19 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.519 -0.548 . . . . 74.400000000000006 109.519 174.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 26.9 m -60.14 -29.72 68.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.532 . . . . 64.310000000000002 110.436 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.882 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -63.93 -26.8 70.45 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 115.62 -0.718 . . . . 43.32 113.048 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.546 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 34.5 mt-10 -72.8 -31.19 64.67 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 117.233 0.517 . . . . 72.549999999999997 110.468 -177.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 43.7 t -73.3 -36.9 50.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.355 0.597 . . . . 75.409999999999997 110.265 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 5.9 t -72.36 -37.75 68.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.957 -0.565 . . . . 54.299999999999997 109.73 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.36 -33.05 73.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.822 -0.627 . . . . 62.420000000000002 111.383 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 3.5 p -69.52 -28.79 66.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.795 0.331 . . . . 62.520000000000003 110.456 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.586 ' CD1' HD12 ' A' ' 14' ' ' LEU . 7.7 t80 -69.77 -37.07 76.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.536 0.684 . . . . 61.030000000000001 109.17 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.748 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 11.1 ttt -71.76 -52.91 15.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.451 -0.795 . . . . 62.109999999999999 111.251 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 14.1 t-105 -52.35 -39.9 61.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.49 -0.777 . . . . 75.010000000000005 111.061 175.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.525 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.43 -36.76 84.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 75.450000000000003 111.126 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 57.7 tp -65.82 -35.18 79.97 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.864 0.364 . . . . 64.340000000000003 110.33 179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.77 73.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 64.430000000000007 110.781 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -64.66 -33.59 76.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.099 -0.501 . . . . 72.140000000000001 110.84 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -74.36 -39.55 62.69 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.947 -0.569 . . . . 73.430000000000007 111.021 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.13 -24.1 51.69 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.936 0.347 . . . . 71.299999999999997 111.936 -178.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.403 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.19 -17.48 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 71.319999999999993 111.089 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -59.0 -38.11 78.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.851 -0.613 . . . . 73.310000000000002 110.251 175.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -75.81 3.22 10.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.625 -0.716 . . . . 73.140000000000001 111.82 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 248' ' ' GLY . . . . . 0.508 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -65.39 -35.01 90.88 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 119.983 -1.103 . . . . 72.439999999999998 110.438 171.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.923 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 78.9 p -77.66 -6.67 54.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.285 -0.458 . . . . 64.230000000000004 111.362 -177.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 62.4 p -109.38 -1.94 18.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.085 0.469 . . . . 70.140000000000001 110.408 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 24.0 t -81.44 -39.8 24.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.721 -0.672 . . . . 72.530000000000001 110.771 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.68 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 1.7 m-85 -145.13 178.71 7.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.132 0.492 . . . . 73.430000000000007 112.075 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.471 ' HG3' HG23 ' B' ' 254' ' ' THR . 13.5 pt-20 -104.5 -43.91 5.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.269 -0.878 . . . . 74.230000000000004 111.516 -172.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.471 HG23 ' HG3' ' B' ' 253' ' ' GLU . 45.7 p -104.77 149.4 25.66 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 116.523 -0.308 . . . . 64.409999999999997 110.287 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.418 ' HB2' ' HE2' ' B' ' 255' ' ' LYS . 10.5 ptmm? -69.62 -26.83 64.62 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.846 0.355 . . . . 73.109999999999999 110.218 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -53.01 -51.35 61.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.64 -0.709 . . . . 71.530000000000001 110.579 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.599 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 92.3 mt-30 -83.7 -46.69 12.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.561 -0.745 . . . . 71.140000000000001 110.344 -178.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.923 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.6 ttt -56.35 -41.74 76.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.458 -0.792 . . . . 63.450000000000003 111.829 -175.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.63 ' HB2' HG21 ' A' ' 85' ' ' ILE . 28.7 tt0 -69.59 -36.41 76.2 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.673 0.273 . . . . 71.540000000000006 110.989 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.68 -6.22 51.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.345 0.593 . . . . 55.420000000000002 110.495 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.68 ' HE3' ' CE2' ' B' ' 252' ' ' PHE . 70.6 mmtt -99.03 -2.33 37.48 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.531 -0.759 . . . . 71.150000000000006 110.944 -177.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.699 ' HG3' ' H ' ' B' ' 263' ' ' GLN . 11.6 ptpt -50.73 -50.77 54.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.853 -0.612 . . . . 71.200000000000003 110.546 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.699 ' H ' ' HG3' ' B' ' 262' ' ' LYS . 12.5 tp60 -79.47 -22.14 44.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 116.145 -0.48 . . . . 72.040000000000006 110.533 -176.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.55 -30.8 37.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.239 -0.437 . . . . 55.049999999999997 111.408 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.508 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 24.0 ptp -83.75 -31.49 25.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.648 -0.871 . . . . 70.209999999999994 108.648 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.49 ' CE ' ' HB3' ' A' ' 77' ' ' LEU . 59.2 mtp -82.64 -3.37 56.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.259 -0.882 . . . . 64.420000000000002 110.442 176.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.44 -42.73 98.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.132 -0.486 . . . . 74.25 110.629 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.662 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 21.0 p90 -105.63 -9.04 17.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.865 -0.607 . . . . 70.120000000000005 111.079 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 3.5 m-30 -55.41 -51.13 67.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 O-C-N 123.074 0.233 . . . . 72.420000000000002 110.785 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.545 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -50.44 -58.5 5.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.893 -0.594 . . . . 74.010000000000005 110.74 176.73 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 271' ' ' ASP . . . . . 0.471 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 19.6 t70 -87.2 63.69 7.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.658 -0.701 . . . . 72.420000000000002 111.108 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 4.9 mmp_? -121.97 -45.66 2.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.111 -0.495 . . . . 64.340000000000003 111.284 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.751 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -92.03 13.28 19.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.3 . . . . 74.040000000000006 110.515 -174.769 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.617 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.0 ttmt -59.3 -54.31 48.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 53.109999999999999 110.84 -178.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -59.97 -41.56 92.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.397 -0.365 . . . . 64.519999999999996 111.41 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.18 -47.97 83.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.385 0.612 . . . . 71.239999999999995 109.963 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.574 HD23 ' HE1' ' A' ' 70' ' ' MET . 41.5 tp -63.18 -36.65 84.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.875 -1.057 . . . . 74.5 110.504 -178.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 278' ' ' ASP . . . . . 0.402 ' N ' ' HE1' ' A' ' 66' ' ' MET . 9.1 t70 -63.71 -42.08 98.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.73 -0.668 . . . . 70.140000000000001 110.458 177.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -76.33 -14.99 60.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.649 -0.705 . . . . 42.210000000000001 111.324 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -94.85 -2.82 50.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.061 0.457 . . . . 74.239999999999995 110.72 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 19.0 mmt -89.49 179.77 5.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.883 -0.599 . . . . 73.439999999999998 110.684 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.704 ' HG2' HD12 ' B' ' 285' ' ' ILE . 42.1 mt-10 69.2 7.13 6.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.292 1.219 . . . . 63.450000000000003 114.292 166.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -64.78 -51.35 62.69 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.969 0.414 . . . . 72.329999999999998 110.297 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -77.14 -23.61 51.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.262 -0.426 . . . . 75.340000000000003 110.477 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.704 HD12 ' HG2' ' B' ' 282' ' ' GLU . 68.5 mt -65.19 -53.19 43.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.936 -0.574 . . . . 70.349999999999994 110.862 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 11.3 pt-20 -67.49 -20.96 65.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.109999999999999 111.78 -178.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 287' ' ' ASN . . . . . 0.421 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 51.5 m-80 -106.54 5.59 29.3 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.778 0.288 . . . . 71.439999999999998 111.778 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.88 -47.42 80.5 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.116 -0.234 . . . . 62.020000000000003 111.187 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.7 -25.26 66.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.149 -0.478 . . . . 71.099999999999994 111.013 -178.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -76.73 -54.9 6.02 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.952 -0.388 . . . . 71.120000000000005 109.952 176.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -59.44 -50.37 74.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.279 -0.419 . . . . 73.430000000000007 111.161 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.487 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 3.1 tmm_? -58.68 -29.48 66.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.412 -0.813 . . . . 74.329999999999998 110.215 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -81.17 -41.57 22.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.091 -0.504 . . . . 54.409999999999997 110.883 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 25.1 p -71.86 -18.34 62.07 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.184 0.439 . . . . 74.540000000000006 112.184 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -98.32 141.99 30.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.462 0.649 . . . . 71.299999999999997 110.939 -178.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 57.2 mttp . . . . . 0 C--O 1.248 0.991 0 CA-C-N 115.095 -0.957 . . . . 72.019999999999996 109.671 177.39 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.4 m . . . . . 0 N--CA 1.478 0.975 0 CA-C-O 120.595 0.236 . . . . 71.230000000000004 110.735 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -79.63 -33.82 41.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.919 0.39 . . . . 63.009999999999998 110.453 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.0 p-10 -150.7 120.53 7.08 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.018 -0.734 . . . . 74.340000000000003 109.018 172.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -78.79 -80.27 0.12 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.173 -0.467 . . . . 62.43 112.011 -171.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -98.78 -21.31 16.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.356 0.598 . . . . 60.020000000000003 110.768 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.68 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -133.16 -179.75 5.69 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.792 -0.64 . . . . 61.020000000000003 111.46 -173.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -83.67 46.13 1.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.334 -0.848 . . . . 65.030000000000001 111.871 -176.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -55.42 -41.13 72.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.772 0.32 . . . . 65.010000000000005 111.55 -176.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.39 -13.41 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 54.350000000000001 111.878 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 41.4 mmt180 -93.32 -60.34 1.81 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.765 -0.198 . . . . 73.040000000000006 110.627 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.789 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.31 -22.44 12.02 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.805 0.669 . . . . 73.120000000000005 112.805 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.592 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.7 t -68.37 -22.41 64.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.678 0.275 . . . . 71.25 110.768 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HB2' HD11 ' B' ' 217' ' ' LEU . 41.3 mt-10 -81.04 -27.61 35.69 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.319 0.58 . . . . 74.430000000000007 109.631 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.789 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -70.36 -48.53 55.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.205 -0.907 . . . . 72.109999999999999 109.724 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.459 HG13 ' HB1' ' B' ' 239' ' ' ALA . 80.6 mt -66.53 -27.86 41.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.469 0.652 . . . . 64.329999999999998 109.91 175.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.592 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.1 OUTLIER -66.74 -29.07 68.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.448 -0.796 . . . . 64.140000000000001 110.743 -177.362 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.663 HD12 HD13 ' B' ' 214' ' ' LEU . 2.8 tm? -75.25 -36.67 61.25 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.329 -0.619 . . . . 71.450000000000003 109.329 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.16 -28.45 70.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.801 -0.636 . . . . 64.409999999999997 110.462 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -76.9 -19.27 57.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.941 -0.572 . . . . 72.219999999999999 110.263 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -73.02 -41.82 63.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.68 -0.691 . . . . 71.409999999999997 109.474 176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -78.93 -19.88 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.31 -0.859 . . . . 70.030000000000001 110.034 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -78.41 -5.86 53.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.663 -0.699 . . . . 44.240000000000002 110.128 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -75.55 -9.77 58.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.24 -0.436 . . . . 74.200000000000003 110.607 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -78.64 111.48 14.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 72.439999999999998 109.726 178.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 25' ' ' THR . 2.9 t -73.37 -27.28 61.39 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.809 -0.632 . . . . 61.450000000000003 112.018 -174.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.26 -3.39 59.04 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.494 0.553 . . . . 64.219999999999999 112.494 -177.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.1 mt -107.45 149.51 10.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.806 -0.442 . . . . 65.530000000000001 109.806 177.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.08 145.06 32.63 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.16 -0.681 . . . . 72.099999999999994 109.16 177.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.491 HG22 ' HZ ' ' B' ' 247' ' ' PHE . 6.6 m -60.35 -25.11 65.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.203 0.525 . . . . 63.329999999999998 110.382 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.66 -15.74 71.3 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.691 -0.686 . . . . 73.209999999999994 112.884 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -81.28 -31.94 33.45 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.367 -0.605 . . . . 74.239999999999995 109.367 176.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -72.36 -44.78 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.467 -0.788 . . . . 63.039999999999999 110.443 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.0 p -60.91 -39.37 89.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.181 0.515 . . . . 64.209999999999994 110.471 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.56 72.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 74.310000000000002 110.788 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.414 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 51.6 m -67.96 -37.27 81.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.769 0.318 . . . . 75.310000000000002 110.159 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.566 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.1 t80 -68.24 -36.18 79.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.105 -0.702 . . . . 61.229999999999997 109.105 175.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.591 ' SD ' HD21 ' B' ' 240' ' ' LEU . 10.3 tpt -60.18 -60.75 3.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.919 -1.037 . . . . 73.219999999999999 110.974 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.486 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 30.7 t-105 -59.52 -33.68 71.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.477 -0.783 . . . . 64.349999999999994 111.428 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.401 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.0 -41.52 90.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 61.420000000000002 111.586 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.59 HD13 ' HB3' ' B' ' 236' ' ' PHE . 50.3 tp -67.35 -33.1 74.53 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.983 0.42 . . . . 74.540000000000006 110.482 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -62.2 -40.12 95.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 22.120000000000001 110.839 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 42' ' ' ARG . 38.2 mtp85 -74.74 -34.8 62.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.804 -0.634 . . . . 72.120000000000005 110.823 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.518 ' HD2' HG23 ' B' ' 215' ' ' ILE . 9.9 t80 -76.53 -35.38 58.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 74.450000000000003 110.739 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -75.1 -34.95 61.78 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 111.807 0.299 . . . . 74.340000000000003 111.807 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.521 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -68.47 -14.87 63.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.974 0.416 . . . . 75.5 111.361 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -58.11 -32.72 68.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.764 -0.653 . . . . 72.439999999999998 110.323 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.574 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 78.1 m-85 -80.38 -7.74 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.902 -0.59 . . . . 34.310000000000002 111.917 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.431 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -58.89 -34.93 80.47 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.452 -0.88 . . . . 64.400000000000006 111.779 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.1 t -72.79 -19.55 61.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.734 0.302 . . . . 71.510000000000005 111.087 -178.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 p -89.72 -14.21 35.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.783 0.325 . . . . 73.400000000000006 110.877 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.1 m -70.91 -32.49 69.44 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.258 -0.428 . . . . 75.150000000000006 111.951 -174.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -179.15 7.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.116 0.484 . . . . 62.219999999999999 111.537 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -99.77 -47.98 4.87 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.083 -0.962 . . . . 75.409999999999997 111.097 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.2 p -99.7 159.1 15.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.691 -0.231 . . . . 75.530000000000001 110.596 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -68.1 -34.95 77.35 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.083 0.24 . . . . 72.129999999999995 111.14 -175.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.31 -47.49 82.02 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.972 0.415 . . . . 73.319999999999993 110.53 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.594 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 95.4 mt-30 -75.43 -32.73 60.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 54.340000000000003 110.314 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.1 ttt -66.26 -45.7 79.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.021 -0.536 . . . . 73.549999999999997 110.782 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.49 ' HB2' HG21 ' B' ' 285' ' ' ILE . 34.0 tt0 -67.15 -29.82 69.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.815 -0.63 . . . . 73.120000000000005 110.753 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.84 -4.11 26.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.379 -0.373 . . . . 60.119999999999997 111.692 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.594 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.3 mmmm -117.67 4.66 12.32 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 120.75 0.31 . . . . 64.5 110.491 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 16.3 ptmt -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.9 -0.591 . . . . 72.329999999999998 110.736 -174.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.411 HE22 ' HE2' ' B' ' 274' ' ' LYS . 16.4 tp60 -68.75 -26.08 65.06 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.87 0.367 . . . . 75.120000000000005 110.559 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.76 -42.97 69.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.974 -0.557 . . . . 65.510000000000005 111.644 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.546 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.8 ptt? -83.75 -27.08 29.15 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.17 -0.612 . . . . 63.299999999999997 109.782 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.641 ' HG2' HD22 ' B' ' 277' ' ' LEU . 75.7 mtp -78.47 -17.79 55.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.628 -0.715 . . . . 75.420000000000002 111.575 -178.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.44 -24.75 66.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.525 -0.917 . . . . 73.299999999999997 108.525 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.536 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 34.7 m-85 -93.71 -32.96 13.82 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 114.414 -1.266 . . . . 74.010000000000005 111.199 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.434 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 23.1 m-85 -60.98 -45.13 96.01 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.204 -0.665 . . . . 71.049999999999997 109.204 175.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.48 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -67.04 -59.83 3.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.375 -0.375 . . . . 72.310000000000002 110.039 169.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -106.34 81.54 1.62 Allowed 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 113.189 0.811 . . . . 74.329999999999998 113.189 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.536 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 7.9 mmm180 -147.13 -31.16 0.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.731 -0.668 . . . . 72.230000000000004 109.757 164.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.629 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -93.08 10.87 29.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.309 -0.626 . . . . 71.319999999999993 109.309 178.148 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -66.36 -56.32 11.67 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.271 -0.877 . . . . 55.229999999999997 110.076 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.62 -36.81 77.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.477 -0.329 . . . . 64.409999999999997 110.925 177.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.0 mtt -62.67 -41.08 98.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.238 0.542 . . . . 74.010000000000005 110.05 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.547 HD22 ' HG2' ' B' ' 266' ' ' MET . 1.2 tt -71.89 -42.11 67.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.486 -0.779 . . . . 43.310000000000002 110.144 -176.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.74 -39.85 82.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.26 0.553 . . . . 54.210000000000001 109.948 175.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.45 -21.22 66.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.324 -0.853 . . . . 72.129999999999995 111.365 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -93.36 -24.04 18.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 70.439999999999998 110.25 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.406 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 25.4 mmt -63.2 -45.59 91.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.523 -0.917 . . . . 71.329999999999998 108.523 169.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 43.4 mm-40 -68.21 12.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.24 -0.891 . . . . 75.230000000000004 111.916 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -93.01 -55.5 3.32 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.902 -0.777 . . . . 54.420000000000002 108.902 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.785 -0.643 . . . . 71.340000000000003 111.808 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.7 mt -62.3 -57.39 12.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.491 0.186 . . . . 73.030000000000001 111.433 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.7 pt-20 -69.18 -15.74 63.47 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.125 0.417 . . . . 42.210000000000001 112.125 -175.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -109.13 10.3 25.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.998 -0.281 . . . . 75.120000000000005 110.942 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.516 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 71.5 t80 -57.87 -47.93 81.3 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.451 -0.34 . . . . 72.299999999999997 111.106 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.72 -27.72 69.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.384 -0.371 . . . . 65.030000000000001 110.443 -177.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -69.76 -51.83 30.61 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.696 -0.483 . . . . 74.409999999999997 109.696 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.56 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 73.1 m-85 -61.47 -44.99 96.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.297 0.57 . . . . 74.230000000000004 110.432 176.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.464 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 3.7 tmm_? -62.03 -22.63 65.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.415 -0.811 . . . . 73.299999999999997 110.128 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -82.45 -26.17 32.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.018 -0.537 . . . . 74.519999999999996 111.083 -178.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 p -90.37 -9.27 48.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.264 -0.426 . . . . 64.109999999999999 111.381 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.56 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 94.6 mt-30 -84.9 155.59 21.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.095 0.474 . . . . 71.319999999999993 111.038 -178.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 97.7 mttt . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.358 -0.837 . . . . 75.510000000000005 110.291 179.689 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.351 0.596 . . . . 54.43 110.274 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 202' ' ' ASN . . . . . 0.415 ' HB3' ' HB2' ' B' ' 209' ' ' ALA . 16.2 m120 -93.3 -11.14 33.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.632 -0.713 . . . . 72.329999999999998 110.127 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.757 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 0.5 OUTLIER -157.95 146.36 18.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.725 -0.67 . . . . 73.420000000000002 109.822 177.499 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -91.05 -75.85 0.46 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.095 -0.706 . . . . 52.32 109.095 178.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -115.5 -37.38 4.02 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.52 -0.919 . . . . 73.150000000000006 108.52 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.757 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -93.99 150.97 19.88 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.162 -0.926 . . . . 73.049999999999997 111.764 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.468 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -71.68 57.89 0.3 Allowed 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 125.064 1.346 . . . . 63.32 113.146 -179.639 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -51.67 -43.06 62.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.479 0.548 . . . . 71.219999999999999 112.479 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 209' ' ' ALA . . . . . 0.415 ' HB2' ' HB3' ' B' ' 202' ' ' ASN . . . -62.25 -27.76 69.23 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.946 0.721 . . . . 74.349999999999994 112.946 -174.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.425 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 19.5 mmt180 -87.66 -56.49 3.33 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.939 -0.304 . . . . 62.409999999999997 111.642 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.601 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -51.75 -25.73 8.1 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.689 0.626 . . . . 73.129999999999995 112.689 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 212' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 6.2 t -69.32 -23.63 63.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 121.336 -0.146 . . . . 52.340000000000003 111.357 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -81.71 -27.87 33.7 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.1 -0.704 . . . . 72.310000000000002 109.1 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.663 HD13 HD12 ' A' ' 17' ' ' LEU . 3.4 mm? -67.08 -51.78 50.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.78 -1.1 . . . . 73.310000000000002 109.467 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.518 HG23 ' HD2' ' A' ' 43' ' ' TYR . 78.1 mt -63.67 -30.37 49.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.515 -0.766 . . . . 75.540000000000006 110.227 176.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.497 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.0 OUTLIER -59.62 -36.98 77.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.8 -0.636 . . . . 70.230000000000004 110.82 -177.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.603 ' HA ' ' NE2' ' B' ' 220' ' ' GLN . 3.0 tm? -67.61 -40.01 84.74 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.128 -0.693 . . . . 71.400000000000006 109.128 178.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.16 66.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.716 -0.675 . . . . 72.349999999999994 110.707 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.562 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 5.2 m-20 -66.28 -42.06 88.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.781 -0.645 . . . . 74.150000000000006 110.488 176.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 220' ' ' GLN . . . . . 0.603 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -61.78 -43.85 98.04 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.834 0.349 . . . . 74.430000000000007 111.158 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -70.16 -21.6 63.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.201 0.524 . . . . 73.209999999999994 110.379 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -79.51 -13.38 59.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.687 -0.688 . . . . 74.540000000000006 109.891 177.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.562 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 20.3 mm-40 -83.77 -2.07 55.55 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.318 -0.401 . . . . 74.510000000000005 110.218 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.425 ' HB3' HG13 ' B' ' 227' ' ' ILE . 0.9 OUTLIER -81.46 103.26 11.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.114 -0.698 . . . . 71.230000000000004 109.114 178.96 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.1 t -59.25 -28.77 67.01 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 113.412 0.893 . . . . 74.040000000000006 113.412 -171.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -87.22 -0.29 56.48 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.931 0.345 . . . . 74.329999999999998 111.931 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.425 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.7 mt -112.24 149.49 14.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.866 -0.42 . . . . 64.549999999999997 109.866 177.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.471 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 0.3 OUTLIER -88.81 151.41 22.4 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.308 -0.627 . . . . 74.040000000000006 109.308 178.723 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.8 m -57.51 -30.83 65.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.262 0.554 . . . . 64.209999999999994 110.202 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.574 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.8 -16.14 74.22 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.461 -0.79 . . . . 71.450000000000003 113.645 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.471 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 7.7 mm-40 -87.79 -24.98 23.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.552 0.676 . . . . 64.540000000000006 109.642 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.13 -40.4 44.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 73.030000000000001 110.242 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.7 p -63.15 -39.04 93.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.202 0.525 . . . . 72.140000000000001 110.271 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.9 -32.99 74.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.751 -0.659 . . . . 64.329999999999998 110.837 178.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 46.8 m -66.73 -37.37 84.53 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.105 0.478 . . . . 61.020000000000003 110.101 178.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.59 ' HB3' HD13 ' A' ' 40' ' ' LEU . 4.4 t80 -67.76 -35.67 79.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 73.340000000000003 109.696 177.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.629 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.3 ttm -67.06 -50.26 62.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.685 -0.689 . . . . 51.109999999999999 111.489 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -59.49 -38.79 81.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.073 0.463 . . . . 63.439999999999998 110.728 178.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.459 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.09 -41.07 91.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.01 -0.541 . . . . 74.439999999999998 111.443 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.591 HD21 ' SD ' ' A' ' 37' ' ' MET . 53.1 tp -65.67 -33.71 76.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.893 0.378 . . . . 55.210000000000001 110.557 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.2 -40.53 97.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 55.25 110.773 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.8 mtp85 -70.7 -42.15 71.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.061 -0.518 . . . . 72.310000000000002 110.604 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -70.6 -37.96 73.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.79 -0.641 . . . . 72.409999999999997 111.179 -174.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -71.83 -34.79 69.6 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.964 0.357 . . . . 52.299999999999997 111.964 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -65.74 -25.69 67.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 64.5 111.153 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -59.56 -33.84 71.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.637 -0.71 . . . . 74.329999999999998 110.113 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.491 ' HZ ' HG22 ' A' ' 29' ' ' THR . 71.5 m-85 -83.68 -8.71 59.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.31 -0.405 . . . . 73.209999999999994 111.33 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 248' ' ' GLY . . . . . 0.515 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -73.56 -30.94 61.38 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.23 -0.986 . . . . 64.239999999999995 110.661 171.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 34.9 t -70.12 -12.25 61.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.299 -0.451 . . . . 62.240000000000002 111.141 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.1 t -113.61 14.07 18.82 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.041 0.448 . . . . 72.109999999999999 110.27 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 29.0 t -88.95 -35.65 16.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.163 -0.472 . . . . 71.010000000000005 110.641 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.507 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.5 OUTLIER -137.95 174.01 11.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.761 0.315 . . . . 75.019999999999996 111.579 178.895 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -92.87 -30.61 15.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.773 -0.649 . . . . 72.430000000000007 112.325 -170.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.2 p -120.58 156.12 32.27 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.811 -0.177 . . . . 65.430000000000007 110.63 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.516 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 12.6 ptmm? -64.33 -29.11 70.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 72.530000000000001 110.37 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 256' ' ' GLU . . . . . 0.49 ' OE2' ' HG3' ' B' ' 255' ' ' LYS . 19.9 mm-40 -63.4 -57.58 9.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 75.430000000000007 110.651 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.697 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 97.5 mt-30 -68.94 -39.09 79.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.968 -0.56 . . . . 74.409999999999997 110.651 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.41 -44.08 96.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.285 -0.416 . . . . 75.099999999999994 110.883 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 54.3 tt0 -62.79 -35.78 80.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.089 0.471 . . . . 74.549999999999997 110.835 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -74.07 -5.81 43.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.006 -0.543 . . . . 64.230000000000004 111.094 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.697 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 14.3 mmmm -114.3 6.79 16.24 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.509 -0.314 . . . . 74.239999999999995 110.448 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.569 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 17.8 ptpt -56.95 -53.2 60.75 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 120.678 -0.409 . . . . 70.430000000000007 110.226 -177.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.556 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 15.0 tp60 -72.45 -22.01 61.15 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.847 -0.427 . . . . 72.140000000000001 109.847 -177.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -69.91 -42.44 73.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.6 -0.727 . . . . 65.400000000000006 111.299 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.569 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.6 ptt? -88.13 -27.7 21.74 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.211 0.529 . . . . 73.099999999999994 109.97 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.547 ' HG2' HD22 ' A' ' 77' ' ' LEU . 80.6 mtp -74.58 -17.51 60.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.684 -0.689 . . . . 75.340000000000003 110.611 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -62.37 -30.12 70.96 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.92 -0.77 . . . . 73.349999999999994 108.92 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.567 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.7 m-85 -86.7 -35.38 19.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.483 -1.235 . . . . 55.450000000000003 111.157 178.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.53 ' HA ' ' HE1' ' A' ' 37' ' ' MET . 22.6 m-30 -61.09 -44.29 97.59 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.485 -0.561 . . . . 73.230000000000004 109.485 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.431 ' N ' ' HE3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.55 -57.3 5.38 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.352 -0.539 . . . . 73.010000000000005 109.679 171.256 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 271' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 7.0 t70 -108.53 81.42 1.47 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.657 0.614 . . . . 74.230000000000004 112.657 -172.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.567 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 5.8 mmm180 -156.81 -26.81 0.09 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.945 -0.57 . . . . 73.150000000000006 110.029 166.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.405 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -95.27 9.32 40.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.469 -0.937 . . . . 74.540000000000006 108.469 174.191 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.437 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 62.1 tttm -64.29 -59.32 4.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.248 -1.342 . . . . 61.210000000000001 110.356 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -55.3 -38.86 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 54.530000000000001 111.013 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 276' ' ' MET . . . . . 0.486 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 50.2 mtt -60.63 -40.99 93.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.447 0.641 . . . . 73.430000000000007 110.412 177.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.641 HD22 ' HG2' ' A' ' 66' ' ' MET . 0.9 OUTLIER -75.01 -41.34 59.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.283 -0.871 . . . . 74.430000000000007 110.274 -178.006 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -57.87 -44.53 86.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 74.010000000000005 110.242 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.47 69.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.127 -0.942 . . . . 44.229999999999997 111.748 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -83.57 -21.49 32.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.9 0.381 . . . . 74.400000000000006 110.528 -178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.521 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 24.3 mmt -68.26 -52.97 27.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.038 -0.528 . . . . 72.430000000000007 110.14 175.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.688 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 40.1 mm-40 -51.08 -37.56 46.43 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.319 -0.855 . . . . 73.099999999999994 112.338 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -50.0 -42.75 49.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.697 0.284 . . . . 62.130000000000003 111.676 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -86.86 -32.16 20.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.857 0.36 . . . . 74.010000000000005 110.595 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.49 HG21 ' HB2' ' A' ' 59' ' ' GLN . 70.5 mt -66.28 -55.31 19.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.935 -0.575 . . . . 74.140000000000001 111.521 -177.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.688 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -75.08 -6.58 50.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 72.430000000000007 111.758 -175.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -116.37 12.37 15.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.328 -0.396 . . . . 75.530000000000001 110.857 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -53.0 -49.23 66.61 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.192 0.307 . . . . 71.329999999999998 111.037 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -57.32 -35.14 69.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.862 -0.608 . . . . 72.109999999999999 111.134 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -70.91 -50.86 30.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 65.319999999999993 109.975 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 291' ' ' TYR . . . . . 0.609 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 65.2 m-85 -57.84 -50.77 72.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.993 -0.549 . . . . 73.540000000000006 110.758 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -22.16 62.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.281 0.562 . . . . 73.219999999999999 110.421 -178.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -82.56 -36.24 26.44 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.017 -0.538 . . . . 54.409999999999997 110.752 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 18.0 p -85.25 -17.99 35.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.997 -0.547 . . . . 73.140000000000001 111.652 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 94.0 mt-30 -84.63 163.87 19.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.251 0.548 . . . . 61.130000000000003 110.858 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 92.1 mttt . . . . . 0 C--O 1.249 1.074 0 CA-C-N 115.224 -0.898 . . . . 63.549999999999997 109.133 179.574 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 110.366 -0.235 . . . . 73.099999999999994 110.366 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -93.52 15.03 16.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.647 0.737 . . . . 43.109999999999999 109.294 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.5 p-10 -158.79 152.91 23.72 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.305 -0.861 . . . . 75.340000000000003 109.612 -178.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -81.77 -81.66 0.14 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.762 0.315 . . . . 71.299999999999997 110.967 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -111.16 -33.13 6.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.899 0.381 . . . . 72.239999999999995 110.875 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.46 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -104.76 159.64 15.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.081 0.467 . . . . 72.519999999999996 111.363 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.1 OUTLIER -76.78 53.66 0.93 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.164 -0.925 . . . . 74.540000000000006 112.481 -177.531 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.425 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 37.8 m-85 -54.39 -38.99 66.81 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.862 0.363 . . . . 71.109999999999999 111.253 -178.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.44 -14.36 60.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.814 -0.63 . . . . 74.310000000000002 112.207 -176.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.616 ' NH1' ' HB3' ' B' ' 231' ' ' GLU . 64.5 mtt180 -93.5 -59.98 1.88 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.051 -0.352 . . . . 74.430000000000007 110.051 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.511 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.83 -25.94 21.92 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.766 -0.652 . . . . 60.409999999999997 112.657 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.5 t -63.95 -22.9 67.13 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.634 0.254 . . . . 61.229999999999997 111.296 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.546 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.9 mt-10 -90.98 -32.25 16.02 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.913 0.387 . . . . 74.349999999999994 109.969 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.614 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.6 mm? -61.92 -45.96 91.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.157 -0.683 . . . . 63.240000000000002 109.157 176.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.598 HG23 ' HD2' ' B' ' 243' ' ' TYR . 92.3 mt -66.86 -28.42 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.404 -0.817 . . . . 64.310000000000002 110.399 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.2 OUTLIER -68.49 -29.91 68.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.857 -0.61 . . . . 70.439999999999998 110.575 -177.101 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.489 HD12 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -69.86 -44.63 69.45 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.69 -0.856 . . . . 75.230000000000004 108.69 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.85 -33.1 74.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.374 -0.83 . . . . 64.439999999999998 109.965 178.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 5.4 t-20 -57.23 -38.7 74.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.221 -0.9 . . . . 52.149999999999999 110.396 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -67.01 -42.17 85.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 63.210000000000001 111.368 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -74.26 -20.32 60.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.053 0.454 . . . . 74.140000000000001 110.53 -177.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -88.04 0.21 56.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 55.240000000000002 110.68 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.9 mm-40 -80.77 55.23 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.868 0.366 . . . . 62.420000000000002 110.467 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -144.62 142.48 30.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 51.530000000000001 109.873 -177.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.5 t -93.18 -43.36 8.89 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.291 0.478 . . . . 53.119999999999997 112.291 -176.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -73.7 -24.75 59.98 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.382 0.512 . . . . 75.450000000000003 112.382 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 5.6 mt -83.76 143.98 10.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.296 -0.631 . . . . 71.430000000000007 109.296 177.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.655 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -83.42 150.68 25.9 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.997 -0.547 . . . . 53.530000000000001 110.017 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 m -56.37 -33.28 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.657 -0.702 . . . . 73.019999999999996 111.375 -175.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.586 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -63.14 -26.53 69.33 Favored Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.945 -0.57 . . . . 42.439999999999998 113.997 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.655 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 51.8 mm-40 -62.97 -28.43 70.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 117.318 0.559 . . . . 72.400000000000006 111.172 -176.001 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.67 -46.78 15.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 73.510000000000005 110.825 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 m -55.7 -40.11 71.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 63.130000000000003 110.983 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.78 68.37 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.14 -0.482 . . . . 64.299999999999997 111.229 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.5 m -66.9 -32.08 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 74.420000000000002 110.107 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.614 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.5 t80 -68.45 -33.11 73.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.872 -0.604 . . . . 74.409999999999997 109.854 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.568 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.5 ttm -68.09 -49.72 59.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 74.510000000000005 111.407 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.477 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 29.3 t-105 -62.02 -37.59 85.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.076 0.465 . . . . 73.25 110.669 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.42 -34.32 76.98 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 54.340000000000003 111.264 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.4 tp -65.64 -35.71 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 120.942 0.401 . . . . 74.230000000000004 110.029 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.524 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -62.11 -54.18 44.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.876 -0.602 . . . . 73.040000000000006 110.985 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -61.9 -32.82 73.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.644 -0.253 . . . . 74.099999999999994 111.602 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.403 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 11.1 t80 -77.4 -39.33 47.49 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.972 -0.291 . . . . 72.409999999999997 110.917 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -70.31 -35.41 73.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 75.150000000000006 110.806 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -69.54 -11.53 60.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.488 . . . . 73.239999999999995 111.129 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.403 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 19.2 t90 -74.19 -15.28 61.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.444 0.64 . . . . 73.099999999999994 109.833 176.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -97.8 -0.93 44.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.998 0.428 . . . . 75.200000000000003 111.142 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -74.94 -29.84 60.26 Favored Glycine 0 N--CA 1.443 -0.841 0 C-N-CA 120.47 -0.872 . . . . 74.439999999999998 111.009 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . 1.024 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 7.0 p -73.15 -5.37 38.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.754 0.311 . . . . 73.299999999999997 111.826 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -120.19 14.01 12.11 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.428 . . . . 63.020000000000003 110.372 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -76.66 -54.93 5.99 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.163 -0.471 . . . . 54.039999999999999 111.884 -178.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.687 ' HE2' ' HE2' ' A' ' 61' ' ' LYS . 3.0 m-85 -128.87 173.55 10.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.034 0.445 . . . . 74.109999999999999 112.076 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.517 ' HG3' HG23 ' A' ' 54' ' ' THR . 12.1 pt-20 -88.51 -36.08 16.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.28 -0.873 . . . . 73.450000000000003 111.459 -172.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.517 HG23 ' HG3' ' A' ' 53' ' ' GLU . 62.9 p -119.85 151.53 38.72 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 116.105 -0.498 . . . . 74.540000000000006 110.283 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.577 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 21.2 ptmt -68.6 -25.07 64.68 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.652 -0.499 . . . . 54.229999999999997 109.652 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -55.2 -40.39 70.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.579 -0.737 . . . . 71.530000000000001 110.468 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.681 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 86.0 mt-30 -93.84 -43.32 8.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.623 -0.717 . . . . 64.030000000000001 110.311 178.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 1.024 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.5 ttt -58.11 -40.64 81.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.642 -0.708 . . . . 71.120000000000005 111.904 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.738 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.8 tt0 -64.38 -41.92 96.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.814 0.34 . . . . 54.130000000000003 110.633 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.56 -18.29 64.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.097 -0.502 . . . . 64.439999999999998 111.164 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.687 ' HE2' ' HE2' ' A' ' 52' ' ' PHE . 32.3 mmmt -91.28 0.35 57.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.11 -0.495 . . . . 70.019999999999996 110.54 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HG2' ' N ' ' A' ' 63' ' ' GLN . 1.5 ptmm? -55.15 -43.05 73.88 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.829 -0.434 . . . . 64.230000000000004 109.829 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.41 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 11.1 tp60 -82.76 -19.61 37.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.278 -0.419 . . . . 64.450000000000003 110.521 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.17 -30.5 20.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.028 -0.533 . . . . 73.099999999999994 111.584 -175.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.3 ptp -82.02 -27.52 33.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.189 -1.041 . . . . 73.239999999999995 108.189 177.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.8 mtp -85.97 -10.02 55.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.899 -1.046 . . . . 73.120000000000005 110.429 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -53.05 -43.55 66.72 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.724 -0.671 . . . . 72.5 111.791 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.57 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 6.6 p90 -109.69 -1.53 17.98 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.159 -0.473 . . . . 73.349999999999994 111.215 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.677 ' HD2' HD21 ' B' ' 277' ' ' LEU . 4.2 m-30 -63.0 -46.99 85.04 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.52 0.2 . . . . 73.530000000000001 110.759 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.478 ' HE1' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.1 -46.22 72.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.415 0.626 . . . . 65.030000000000001 110.042 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -89.65 14.07 12.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.089 -0.959 . . . . 75.409999999999997 112.172 -168.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.736 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -86.08 -43.05 13.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.584 -0.697 . . . . 73.319999999999993 111.443 -172.065 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.685 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -98.68 15.29 25.68 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.389 -0.524 . . . . 55.539999999999999 110.212 -178.347 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.589 ' HE3' ' HG2' ' B' ' 270' ' ' MET . 32.8 ttmt -62.86 -52.92 61.26 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.705 -0.68 . . . . 72.129999999999995 109.576 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 75' ' ' GLU . 6.4 pt-20 -57.49 -41.41 80.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.137 -0.938 . . . . 73.400000000000006 111.135 177.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -61.16 -47.32 86.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.262 0.554 . . . . 73.200000000000003 110.592 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.591 HD13 ' HE1' ' B' ' 270' ' ' MET . 1.0 OUTLIER -69.66 -36.09 75.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.245 -0.889 . . . . 72.430000000000007 110.63 -174.551 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.46 ' N ' ' HE1' ' B' ' 266' ' ' MET . 19.2 t70 -61.12 -31.2 70.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.237 0.542 . . . . 51.219999999999999 110.532 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.9 59.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.602 -0.726 . . . . 72.340000000000003 111.524 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -105.46 -16.57 14.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.057 0.456 . . . . 75.409999999999997 110.662 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.446 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 20.9 mmt -75.97 -179.15 4.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.797 -0.638 . . . . 73.239999999999995 111.415 177.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.603 ' HA ' ' CG1' ' A' ' 85' ' ' ILE . 40.5 mt-10 67.8 8.74 6.63 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.878 -1.055 . . . . 64.010000000000005 113.718 171.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.29 -55.26 35.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.145 0.497 . . . . 74.129999999999995 110.648 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -85.24 -10.23 56.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.95 -0.568 . . . . 70.439999999999998 111.012 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.603 ' CG1' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -76.0 -57.33 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 120.757 0.313 . . . . 74.430000000000007 110.744 -178.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.0 pt-20 -66.8 -25.56 66.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.735 0.302 . . . . 74.120000000000005 110.872 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -99.0 7.26 46.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.337 -0.392 . . . . 65.150000000000006 111.304 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.404 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 77.8 t80 -60.02 -39.34 85.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.708 0.289 . . . . 73.239999999999995 110.466 -179.001 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.95 -38.95 68.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.324 0.583 . . . . 70.140000000000001 110.478 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -68.6 -48.87 63.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.509 -0.769 . . . . 71.420000000000002 110.168 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -64.7 -32.17 73.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.928 0.394 . . . . 72.120000000000005 111.205 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -13.36 61.66 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.522 0.677 . . . . 64.430000000000007 110.094 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -97.28 -41.47 8.25 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.569 -0.741 . . . . 35.350000000000001 110.545 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 40.3 p -92.07 18.09 8.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.187 -0.46 . . . . 72.230000000000004 111.592 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -61.21 152.43 28.87 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.217 0.532 . . . . 72.510000000000005 111.072 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.404 ' NZ ' ' HB2' ' A' ' 96' ' ' LYS . 8.0 mtmp? . . . . . 0 C--N 1.32 -0.712 0 CA-C-N 115.753 -0.658 . . . . 73.430000000000007 110.963 -173.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 21.2 m . . . . . 0 C--O 1.234 0.255 0 CA-C-O 120.98 0.419 . . . . 71.450000000000003 110.722 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -85.16 11.54 9.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.718 0.77 . . . . 72.230000000000004 109.8 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.692 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.4 OUTLIER -149.76 154.16 38.03 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.027 -0.988 . . . . 74.109999999999999 108.805 176.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.14 -79.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.799 0.333 . . . . 75.040000000000006 111.502 -176.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.41 -56.32 2.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.1 0.476 . . . . 63.130000000000003 110.112 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -71.28 160.39 32.89 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.757 -0.656 . . . . 61.549999999999997 110.642 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.477 ' HE1' ' CB ' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -76.62 52.26 0.8 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.598 -0.728 . . . . 73.230000000000004 112.251 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.692 ' HD2' ' HB2' ' B' ' 203' ' ' ASN . 55.8 m-85 -55.62 -37.51 68.27 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.965 0.412 . . . . 73.349999999999994 111.179 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -70.49 -20.6 62.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.537 . . . . 74.099999999999994 111.689 -176.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.41 ' NH1' ' HB3' ' A' ' 31' ' ' GLU . 79.4 mtt180 -91.6 -60.6 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.83 0.348 . . . . 73.129999999999995 110.228 -177.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.78 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -56.7 -22.88 38.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.715 -0.675 . . . . 72.120000000000005 112.669 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 212' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -65.97 -24.82 66.87 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.591 0.234 . . . . 71.319999999999993 110.741 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 38.8 mt-10 -83.04 -25.94 31.64 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.423 0.63 . . . . 62.140000000000001 109.865 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.59 -42.84 91.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.351 -0.84 . . . . 70.230000000000004 109.512 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 79.6 mt -68.58 -26.53 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.629 -0.714 . . . . 62.219999999999999 110.221 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.513 ' HB2' ' O ' ' B' ' 213' ' ' GLU . 10.6 mmmm -60.73 -42.27 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.056 -0.52 . . . . 75.239999999999995 111.66 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.576 HD12 HD13 ' A' ' 14' ' ' LEU . 2.6 tm? -64.33 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.164 -0.68 . . . . 63.020000000000003 109.164 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -72.28 -37.55 68.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.777 -0.647 . . . . 74.329999999999998 109.979 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.644 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.2 m-20 -61.0 -34.28 74.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 72.530000000000001 110.689 176.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.07 -38.37 79.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 72.340000000000003 111.572 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -76.61 -22.61 53.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.348 0.594 . . . . 73.219999999999999 110.198 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -78.99 -13.28 59.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.261 -0.882 . . . . 70.5 110.714 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 84.8 mm-40 -72.3 -7.36 49.06 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.336 0.495 . . . . 74.109999999999999 112.336 -176.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.42 ' HB3' HG13 ' B' ' 227' ' ' ILE . 0.6 OUTLIER -71.43 166.8 20.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 72.540000000000006 110.194 -179.675 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.6 t -116.48 3.01 13.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.772 0.32 . . . . 63.32 111.43 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -128.93 7.08 5.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.023 0.379 . . . . 74.099999999999994 112.023 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.42 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.5 mt -109.9 144.45 18.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.284 -0.566 . . . . 75.219999999999999 110.118 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -79.4 142.26 36.13 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.162 -0.927 . . . . 71.049999999999997 109.066 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 39.3 m -60.2 -27.64 67.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.063 0.459 . . . . 75.409999999999997 110.649 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.85 -15.42 76.01 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.912 -0.585 . . . . 74.420000000000002 112.843 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.616 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 68.1 mm-40 -78.25 -18.22 55.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 117.194 0.497 . . . . 74.120000000000005 110.467 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.3 -38.25 10.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.669 -0.696 . . . . 75.040000000000006 110.497 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.1 p -64.4 -38.77 92.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.236 0.541 . . . . 71.400000000000006 110.347 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.12 -37.47 85.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.776 -0.647 . . . . 55.210000000000001 111.103 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.49 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 2.3 p -71.65 -26.41 62.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.97 -0.292 . . . . 54.549999999999997 110.748 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.549 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 6.9 t80 -70.28 -40.63 74.21 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.088 -0.708 . . . . 72.530000000000001 109.088 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.685 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.7 ttm -65.79 -47.87 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.48 -0.782 . . . . 74.439999999999998 111.344 178.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -60.92 -38.42 85.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.995 0.426 . . . . 74.349999999999994 110.701 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.465 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.2 -33.15 75.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 63.420000000000002 111.449 -178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.584 HD13 ' HB3' ' A' ' 36' ' ' PHE . 49.3 tp -70.05 -34.95 73.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.976 0.417 . . . . 70.420000000000002 109.891 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.48 -48.86 77.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.788 -0.642 . . . . 75.329999999999998 110.821 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -77.95 -14.9 59.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 63.310000000000002 111.028 -175.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.598 ' HD2' HG23 ' A' ' 15' ' ' ILE . 28.0 t80 -89.13 -48.91 7.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.222 0.534 . . . . 70.450000000000003 110.349 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -78.58 -16.38 57.48 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.846 -0.615 . . . . 73.150000000000006 112.015 -170.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -66.99 -15.42 63.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.147 0.499 . . . . 61.32 111.008 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -56.96 -31.74 65.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.443 -0.799 . . . . 64.319999999999993 111.506 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.586 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 67.9 m-85 -73.5 -11.64 60.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.316 -0.402 . . . . 73.209999999999994 112.0 -175.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.42 95.76 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.15 -1.024 . . . . 65.519999999999996 111.384 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.917 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 13.1 m -66.85 -13.17 61.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.057 0.392 . . . . 51.200000000000003 112.057 -175.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.8 t -116.81 18.29 14.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.072 0.463 . . . . 53.539999999999999 110.582 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 30.2 t -83.48 -49.24 9.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 75.239999999999995 111.568 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 1.6 m-85 -139.5 -179.45 5.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.653 0.612 . . . . 74.25 112.653 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.599 ' HG3' HG23 ' B' ' 254' ' ' THR . 15.5 pt-20 -92.13 -36.41 13.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.836 -1.074 . . . . 75.120000000000005 112.043 -171.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.599 HG23 ' HG3' ' B' ' 253' ' ' GLU . 69.8 p -123.17 154.92 38.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.328 -0.396 . . . . 72.109999999999999 110.181 -176.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.404 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 22.7 ptmt -65.04 -29.78 70.71 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.154 0.284 . . . . 71.430000000000007 110.72 -178.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -59.0 -53.03 63.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.281 0.562 . . . . 75.349999999999994 110.849 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.637 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 92.0 mt-30 -78.54 -35.3 46.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.663 -0.699 . . . . 71.430000000000007 110.361 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.917 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 25.6 ttt -64.26 -42.86 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.895 -0.593 . . . . 72.150000000000006 111.105 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.45 -35.48 79.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 75.239999999999995 110.887 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.6 2.9 7.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.925 0.393 . . . . 70.540000000000006 111.459 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.637 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.7 mmmt -114.65 -0.16 13.71 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 109.895 -0.409 . . . . 73.140000000000001 109.895 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.458 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 9.9 ptmt -55.22 -52.17 64.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.84 -0.618 . . . . 61.149999999999999 110.942 -173.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.458 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 5.7 tp-100 -76.72 -26.05 54.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 109.985 -0.376 . . . . 71.239999999999995 109.985 -177.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -75.05 -34.13 61.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.05 -0.523 . . . . 75.340000000000003 111.633 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 22.0 ptp -81.49 -29.26 33.73 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.372 -0.973 . . . . 75.409999999999997 108.372 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.478 ' HG2' HD22 ' A' ' 77' ' ' LEU . 68.0 mtp -80.86 -19.17 45.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.914 -1.039 . . . . 71.409999999999997 111.253 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -68.64 -27.32 65.9 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-O 122.079 0.942 . . . . 73.549999999999997 108.5 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -99.94 8.8 43.81 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.216 -1.356 . . . . 71.219999999999999 111.277 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.4 m-30 -97.05 -45.93 6.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 106.951 -1.5 . . . . 74.310000000000002 106.951 165.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.591 ' HE1' HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -59.69 -66.05 0.58 Allowed 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.407 -0.815 . . . . 73.519999999999996 110.53 170.486 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 271' ' ' ASP . . . . . 0.575 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 4.8 t70 -102.03 76.5 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.101 0.408 . . . . 73.209999999999994 112.101 -171.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.575 ' HG2' ' O ' ' B' ' 271' ' ' ASP . 1.8 mmp_? -152.23 -28.92 0.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 72.120000000000005 111.383 170.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.568 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.62 1.44 42.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.525 -0.917 . . . . 74.230000000000004 108.525 174.613 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.48 -49.32 77.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.485 -1.234 . . . . 64.120000000000005 110.692 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.75 -42.65 99.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 73.120000000000005 110.866 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 54.3 mtt -61.55 -47.65 84.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.625 -0.716 . . . . 73.0 109.676 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.677 HD21 ' HD2' ' A' ' 69' ' ' TYR . 34.3 tp -59.9 -42.86 94.77 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.644 -1.162 . . . . 52.439999999999998 111.165 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.94 -43.13 99.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.196 0.522 . . . . 73.209999999999994 110.14 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.04 -20.75 60.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.391 -0.822 . . . . 53.039999999999999 111.525 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -87.95 -9.51 53.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 74.299999999999997 110.634 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.428 ' HG2' ' HB1' ' A' ' 45' ' ' ALA . 58.3 mtt -93.35 -169.23 2.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.104 -0.498 . . . . 75.319999999999993 111.07 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.782 ' HG2' HD12 ' B' ' 285' ' ' ILE . 38.4 mt-10 69.47 13.93 8.36 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.899 -1.046 . . . . 75.319999999999993 112.311 177.075 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -65.48 -47.03 77.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.958 0.409 . . . . 71.5 110.073 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 284' ' ' TYR . . . . . 0.459 ' O ' ' HB2' ' B' ' 288' ' ' PHE . 4.3 m-85 -89.45 -5.44 57.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.508 -0.315 . . . . 72.430000000000007 111.006 174.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.782 HD12 ' HG2' ' B' ' 282' ' ' GLU . 60.8 mt -79.54 -59.79 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 110.138 -0.319 . . . . 60.399999999999999 110.138 178.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 3.1 pt-20 -65.56 -27.89 68.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.867 0.365 . . . . 45.109999999999999 110.701 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -98.52 7.09 46.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.426 -0.352 . . . . 75.040000000000006 111.054 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' B' ' 284' ' ' TYR . 76.9 t80 -64.35 -37.54 87.87 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.93 -0.767 . . . . 71.129999999999995 108.93 174.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -53.27 -32.16 47.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.414 -0.812 . . . . 72.329999999999998 110.252 173.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -78.47 -56.16 4.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.297 -0.865 . . . . 71.329999999999998 110.021 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -62.3 -39.26 92.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.231 -0.44 . . . . 75.209999999999994 111.91 -176.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.416 ' HD3' ' OE1' ' B' ' 295' ' ' GLN . 17.3 tpp180 -66.22 -19.05 65.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.122 0.487 . . . . 73.400000000000006 110.339 177.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -96.73 -23.01 16.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.283 -0.417 . . . . 61.229999999999997 111.504 -177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.9 p -111.12 18.68 19.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.13 0.49 . . . . 72.400000000000006 111.066 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.416 ' OE1' ' HD3' ' B' ' 292' ' ' ARG . 18.1 pt20 -69.25 160.44 31.19 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.77 -0.65 . . . . 72.409999999999997 111.11 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? . . . . . 0 C--N 1.318 -0.803 0 CA-C-N 115.251 -0.886 . . . . 74.409999999999997 109.166 177.469 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.592 0.234 . . . . 73.420000000000002 110.383 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 56.53 52.67 9.51 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.709 -0.678 . . . . 74.329999999999998 111.29 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.63 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.9 p-10 -157.52 132.68 8.87 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.973 -0.558 . . . . 71.030000000000001 110.769 178.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.79 -72.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.583 -0.735 . . . . 72.400000000000006 111.111 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -120.63 -57.59 1.89 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.196 -0.456 . . . . 74.219999999999999 109.822 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.29 161.94 28.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.871 -0.604 . . . . 75.140000000000001 110.981 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.53 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -79.72 54.85 1.9 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.384 -0.826 . . . . 62.340000000000003 111.948 -179.078 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 33.0 m-85 -52.14 -45.29 64.94 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.379 -0.373 . . . . 73.140000000000001 111.962 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.54 -10.57 58.67 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 112.441 0.534 . . . . 64.239999999999995 112.441 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.463 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 95.5 mtt180 -91.33 -62.07 1.52 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.901 -0.407 . . . . 54.310000000000002 109.901 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.773 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.28 -25.03 31.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.772 0.656 . . . . 71.319999999999993 112.772 -178.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 15.1 t -64.73 -20.81 66.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.147 -0.221 . . . . 75.030000000000001 111.321 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HB2' HD11 ' B' ' 217' ' ' LEU . 39.7 mt-10 -86.22 -30.81 22.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.423 -0.584 . . . . 73.5 109.423 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.68 -47.08 82.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.168 -0.924 . . . . 75.329999999999998 109.021 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.46 HG13 ' HB1' ' B' ' 239' ' ' ALA . 72.3 mt -67.16 -29.87 47.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.483 -0.781 . . . . 73.400000000000006 110.389 175.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 12' ' ' THR . 1.2 tmmt? -64.02 -32.31 73.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 62.149999999999999 110.475 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 17' ' ' LEU . 1.6 tm? -69.33 -43.88 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.997 -0.742 . . . . 75.530000000000001 108.997 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.8 84.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.947 -0.569 . . . . 71.540000000000006 110.694 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.529 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 8.0 m-80 -59.4 -32.89 70.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.842 -0.617 . . . . 73.409999999999997 110.944 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -73.88 -31.82 63.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 60.109999999999999 111.53 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -84.73 -22.33 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.827 0.346 . . . . 72.209999999999994 111.023 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -83.6 -0.48 50.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.275 0.56 . . . . 62.450000000000003 110.088 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.2 mm-40 -75.69 -13.69 60.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 73.230000000000004 109.814 173.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -69.2 114.98 7.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.513 -0.767 . . . . 72.010000000000005 109.681 179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -62.65 -34.54 77.29 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.405 0.891 . . . . 70.030000000000001 113.405 -170.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 pm0 -90.96 1.19 57.24 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.42 -0.512 . . . . 73.430000000000007 112.175 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.443 ' CG2' ' HB2' ' A' ' 31' ' ' GLU . 7.6 mt -104.09 149.46 7.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.423 0.63 . . . . 75.140000000000001 110.158 177.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.545 ' CG ' ' HG3' ' A' ' 31' ' ' GLU . 16.8 pt20 -90.46 155.74 18.7 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.104 -0.953 . . . . 74.319999999999993 109.143 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 m -60.73 -21.51 63.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.478 0.656 . . . . 65.439999999999998 110.259 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.45 ' HA2' ' CZ ' ' B' ' 247' ' ' PHE . . . -67.15 -39.85 92.63 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.38 -0.827 . . . . 73.329999999999998 113.283 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.545 ' HG3' ' CG ' ' A' ' 28' ' ' GLN . 42.8 mt-10 -67.85 -32.03 72.27 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 117.488 0.644 . . . . 75.239999999999995 110.317 -174.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -72.68 -41.37 62.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.565 -0.743 . . . . 74.329999999999998 110.385 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -61.83 -44.73 96.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.211 0.529 . . . . 72.409999999999997 110.277 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.24 -32.55 73.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.867 -0.606 . . . . 62.020000000000003 111.031 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 48.8 m -66.0 -37.95 87.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 121.046 0.45 . . . . 61.329999999999998 109.905 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.649 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.6 t80 -63.77 -40.01 95.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.731 -0.668 . . . . 53.530000000000001 109.774 177.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.76 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.9 ttm -66.47 -46.19 77.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.609 -0.723 . . . . 65.540000000000006 111.831 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.453 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 19.9 t-105 -63.08 -36.94 85.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 74.129999999999995 110.947 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.497 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -66.44 -37.89 86.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.094 -0.503 . . . . 74.519999999999996 111.493 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.588 HD13 ' HB3' ' B' ' 236' ' ' PHE . 44.4 tp -69.98 -28.45 65.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.013 0.435 . . . . 72.400000000000006 110.375 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.561 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -63.16 -42.26 99.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.948 -0.569 . . . . 73.340000000000003 111.0 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -77.41 -28.91 52.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.923 0.392 . . . . 72.329999999999998 110.574 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -76.7 -35.13 58.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.124 -0.489 . . . . 74.430000000000007 110.574 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -77.92 -32.17 51.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.308 -0.405 . . . . 73.109999999999999 112.048 -178.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.89 -20.65 66.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.266 0.555 . . . . 51.439999999999998 110.708 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -60.13 -33.56 72.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.265 -0.879 . . . . 72.530000000000001 111.078 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.9 m-85 -77.92 -3.49 42.07 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.154 -0.475 . . . . 75.239999999999995 112.156 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.51 -27.48 70.94 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.163 -1.018 . . . . 72.209999999999994 110.748 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.774 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 3.7 m -65.32 -18.1 65.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.13 -0.535 . . . . 72.349999999999994 111.833 -177.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -114.69 20.33 15.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.056 0.455 . . . . 71.400000000000006 110.88 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -83.48 -59.51 2.42 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.375 -0.375 . . . . 72.019999999999996 111.586 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.698 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 4.8 m-85 -134.86 175.32 9.67 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.106 0.41 . . . . 64.219999999999999 112.106 -175.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.527 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.0 pt-20 -82.37 -40.29 21.53 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.707 -0.678 . . . . 75.450000000000003 111.854 -170.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.527 HG23 ' HG3' ' A' ' 53' ' ' GLU . 80.6 p -119.65 155.48 32.25 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.865 -0.42 . . . . 43.109999999999999 109.865 -178.343 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.5 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 12.1 ptmm? -67.44 -26.41 66.39 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.581 -0.448 . . . . 72.120000000000005 110.418 -176.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.0 -26.83 65.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.188 -0.46 . . . . 55.109999999999999 111.038 -177.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.734 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 88.2 mt-30 -97.21 -43.54 7.31 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.521 -0.548 . . . . 73.340000000000003 109.521 175.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.774 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 11.2 ttt -55.31 -44.21 75.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.169 -0.923 . . . . 55.030000000000001 111.721 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.427 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 47.5 tt0 -63.9 -42.42 97.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.077 -0.511 . . . . 65.510000000000005 110.827 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.71 -2.85 18.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.028 -0.533 . . . . 75.519999999999996 111.712 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.734 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 73.4 mmtt -104.1 1.05 30.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.422 -0.354 . . . . 52.140000000000001 110.826 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.528 ' O ' ' HG3' ' A' ' 66' ' ' MET . 0.0 OUTLIER -52.93 -46.01 67.92 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 123.209 0.318 . . . . 74.400000000000006 110.809 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.471 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 4.1 tp-100 -77.91 -27.96 49.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.045 0.45 . . . . 74.019999999999996 110.014 -174.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -74.17 -29.38 61.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.892 -0.594 . . . . 72.319999999999993 111.176 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 ptp -86.1 -28.08 24.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.488 -0.56 . . . . 74.439999999999998 109.488 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.637 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 86.2 mtp -75.34 -18.14 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.548 -0.751 . . . . 73.140000000000001 111.313 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.0 -31.85 73.08 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.861 0.839 . . . . 51.409999999999997 109.465 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.44 ' HD2' ' CD ' ' A' ' 72' ' ' ARG . 85.9 m-85 -93.73 -4.34 50.6 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.639 -1.164 . . . . 73.349999999999994 111.155 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.637 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.8 m-30 -86.49 -53.87 4.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.014 -1.106 . . . . 74.420000000000002 108.014 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.548 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -58.96 -65.43 0.67 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.999 -0.546 . . . . 64.230000000000004 111.602 175.553 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.568 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 0.1 OUTLIER -98.77 24.2 7.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.861 1.43 . . . . 74.230000000000004 114.861 -159.807 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.44 ' CD ' ' HD2' ' A' ' 68' ' ' TYR . 1.2 mmp_? -112.96 -19.92 11.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.388 -0.925 . . . . 51.520000000000003 112.997 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.664 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -88.78 5.01 45.53 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.745 -0.835 . . . . 73.129999999999995 108.745 173.251 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -61.57 -57.75 10.83 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.414 -1.266 . . . . 74.030000000000001 110.519 -177.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.34 -33.68 76.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.183 -0.462 . . . . 70.209999999999994 111.708 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.496 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 44.6 mtm -74.35 -23.29 59.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.276 0.56 . . . . 50.450000000000003 110.16 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.557 HD22 ' HG2' ' B' ' 266' ' ' MET . 3.4 tt -76.68 -35.29 58.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.566 -0.743 . . . . 71.219999999999999 109.209 176.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.457 ' N ' ' HE1' ' B' ' 266' ' ' MET . 25.2 t70 -59.6 -37.21 77.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.054 -0.976 . . . . 55.109999999999999 111.213 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.37 -19.5 63.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.8 -0.636 . . . . 64.310000000000002 112.095 -178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.24 -3.51 31.32 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 74.319999999999993 111.852 -176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.489 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 24.1 mmt -85.51 -176.26 6.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.696 0.284 . . . . 74.430000000000007 110.534 175.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.756 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 63.0 -10.46 0.1 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 114.027 1.121 . . . . 74.019999999999996 114.027 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -56.17 -65.37 0.61 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.039 0.447 . . . . 63.520000000000003 111.381 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -72.91 -13.38 61.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.29 -0.414 . . . . 72.230000000000004 110.905 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.756 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.6 mt -76.89 -54.32 13.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.431 . . . . 72.430000000000007 110.83 -176.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.2 pt-20 -68.7 -22.37 64.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.982 0.42 . . . . 73.219999999999999 111.106 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -98.57 3.34 48.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.291 -0.413 . . . . 74.219999999999999 110.878 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 73.3 t80 -64.73 -37.42 87.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.733 -0.212 . . . . 75.409999999999997 110.491 -177.001 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -52.29 -42.28 63.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.584 0.707 . . . . 74.219999999999999 109.76 174.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -70.55 -44.96 66.37 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.935 -1.03 . . . . 70.109999999999999 110.849 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.556 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 57.4 m-85 -62.18 -40.08 94.84 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.234 0.54 . . . . 62.149999999999999 110.521 178.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.536 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 0.5 OUTLIER -61.35 -22.97 65.42 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.818 -0.628 . . . . 75.010000000000005 111.901 176.003 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -84.8 -27.6 26.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.113 -0.494 . . . . 63.409999999999997 111.354 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 17.9 p -97.11 1.92 50.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.21 0.528 . . . . 75.310000000000002 111.285 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 48.4 mt-30 -95.24 -175.44 3.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.875 -0.602 . . . . 74.239999999999995 110.925 177.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt . . . . . 0 C--N 1.322 -0.62 0 CA-C-N 115.66 -0.7 . . . . 54.130000000000003 110.545 -174.759 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 38.6 m . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 121.105 0.478 . . . . 65.120000000000005 110.555 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -82.65 97.14 8.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.585 . . . . 51.109999999999999 110.629 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.72 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 2.8 p-10 -166.25 130.44 2.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.023 0.439 . . . . 64.140000000000001 109.913 177.302 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -77.02 -76.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.995 -0.548 . . . . 55.420000000000002 110.891 -177.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -106.75 -45.31 4.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.472 0.653 . . . . 72.219999999999999 109.863 -178.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.72 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -102.18 169.33 8.79 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 73.140000000000001 111.173 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.53 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -83.77 54.25 2.82 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.833 0.853 . . . . 75.140000000000001 112.063 -177.474 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' B' ' 206' ' ' ALA . 29.1 m-85 -53.81 -43.54 69.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.474 . . . . 71.129999999999995 112.086 -175.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -71.34 -5.83 35.44 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.628 0.603 . . . . 43.240000000000002 112.628 -175.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -98.97 -59.97 1.62 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.906 -0.405 . . . . 73.239999999999995 109.906 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.909 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -59.35 -18.52 39.15 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.845 0.683 . . . . 63.119999999999997 112.845 -178.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.8 t -66.95 -19.62 65.75 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.131 -0.228 . . . . 61.439999999999998 111.094 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.407 ' HB2' HD11 ' A' ' 17' ' ' LEU . 33.4 mt-10 -86.67 -26.62 24.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.189 0.519 . . . . 73.230000000000004 109.894 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.909 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.45 -47.87 74.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.406 -0.815 . . . . 72.340000000000003 109.547 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.483 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.5 mt -66.3 -30.17 49.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.801 -0.636 . . . . 65.430000000000007 110.127 175.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' B' ' 216' ' ' LYS . 1.1 tmmt? -64.06 -31.85 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.575 -0.739 . . . . 71.120000000000005 111.204 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.668 HD12 HD13 ' A' ' 14' ' ' LEU . 2.8 tm? -67.86 -42.0 81.99 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.664 -0.865 . . . . 71.319999999999993 108.664 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.19 -35.8 76.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.677 -0.692 . . . . 60.130000000000003 110.719 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.434 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 5.6 m-20 -63.2 -25.54 68.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.052 -0.522 . . . . 72.209999999999994 111.347 179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.52 -36.26 29.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.45 -0.341 . . . . 71.109999999999999 111.304 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -74.77 -22.82 58.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.276 0.56 . . . . 61.439999999999998 110.354 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -72.65 -17.05 61.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.176 -0.92 . . . . 63.119999999999997 110.084 177.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 78.5 mm-40 -77.32 74.83 3.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.071 -0.513 . . . . 73.540000000000006 110.623 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.483 HD21 ' HA ' ' B' ' 224' ' ' ASN . 0.9 OUTLIER -151.15 176.8 10.83 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.567 -0.901 . . . . 74.109999999999999 108.567 174.434 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.8 t -111.82 -37.94 4.99 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.397 -0.521 . . . . 74.329999999999998 112.082 -176.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -83.32 -28.02 29.35 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.171 0.434 . . . . 71.140000000000001 112.171 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 5.7 mt -76.87 151.01 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 72.519999999999996 110.257 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.603 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 13.8 pm0 -101.96 157.05 17.14 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.872 -0.604 . . . . 73.409999999999997 109.487 173.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 17.8 m -58.18 -23.93 57.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.173 0.511 . . . . 63.140000000000001 110.86 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.459 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.84 -35.39 91.85 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.588 -0.733 . . . . 51.420000000000002 113.199 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.603 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 14.9 mm-40 -70.16 -24.84 63.22 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 117.276 0.538 . . . . 64.219999999999999 110.342 -175.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.24 -41.47 22.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.737 -0.665 . . . . 74.319999999999993 110.289 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.0 t -62.11 -43.71 98.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 64.239999999999995 110.297 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.7 -33.02 74.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.961 -0.563 . . . . 64.420000000000002 110.983 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.411 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 50.4 m -65.54 -38.41 89.56 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.013 0.435 . . . . 54.509999999999998 110.084 179.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.596 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.4 t80 -65.24 -36.53 84.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.587 0.708 . . . . 75.439999999999998 109.501 176.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.664 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.0 ttm -66.41 -49.39 66.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.287 -0.87 . . . . 74.340000000000003 111.949 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.53 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 21.6 t-105 -62.92 -37.82 88.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 71.540000000000006 110.732 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.572 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.89 -36.87 85.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.176 -0.465 . . . . 55.329999999999998 111.304 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 54.5 tp -67.76 -33.65 75.26 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.046 0.45 . . . . 64.120000000000005 110.166 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.547 ' HB1' ' HA ' ' A' ' 77' ' ' LEU . . . -60.99 -48.17 83.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 72.129999999999995 110.988 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -67.87 -34.78 77.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.331 -0.395 . . . . 74.120000000000005 111.08 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -74.14 -38.01 63.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.074 -0.512 . . . . 74.439999999999998 110.726 -176.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -75.2 -28.39 59.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.659 0.244 . . . . 71.140000000000001 111.659 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.489 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.37 -15.6 62.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.286 0.565 . . . . 53.100000000000001 110.809 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -67.05 -33.99 76.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.451 -0.795 . . . . 75.0 110.561 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.45 ' CZ ' ' HA2' ' A' ' 30' ' ' GLY . 76.8 m-85 -78.68 -0.74 31.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.57 . . . . 72.030000000000001 112.044 -176.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 248' ' ' GLY . . . . . 0.533 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.93 -36.33 72.85 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.42 -0.895 . . . . 72.140000000000001 111.235 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.804 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 5.1 m -68.37 -11.83 60.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.469 -0.365 . . . . 53.329999999999998 111.611 -178.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 27.1 p -105.85 1.77 27.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.964 0.411 . . . . 72.010000000000005 110.59 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 32.0 t -77.98 -43.2 30.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.952 -0.567 . . . . 55.229999999999997 111.198 -175.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.503 ' HD1' ' HG2' ' B' ' 253' ' ' GLU . 0.3 OUTLIER -144.0 -179.71 6.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.36 0.6 . . . . 63.5 112.561 -174.08 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.503 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 7.1 pt-20 -94.49 -47.53 6.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.74 -1.118 . . . . 74.340000000000003 111.872 -172.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 74.3 p -111.91 156.49 21.98 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 109.538 -0.541 . . . . 72.239999999999995 109.538 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.3 ptmt -68.02 -31.89 71.88 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.422 -0.511 . . . . 64.340000000000003 110.701 -177.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -65.98 -37.1 85.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.941 0.4 . . . . 52.509999999999998 111.044 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.523 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 98.8 mt-30 -90.55 -14.8 31.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.281 -0.418 . . . . 74.109999999999999 110.828 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.804 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.9 ttt -89.06 -40.17 13.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.942 -0.572 . . . . 74.109999999999999 110.541 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.488 ' O ' ' HD2' ' B' ' 262' ' ' LYS . 32.8 tt0 -63.02 -34.52 77.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 73.450000000000003 110.802 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.68 -3.63 19.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.352 -0.386 . . . . 71.340000000000003 110.709 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 73.3 mmtt -115.62 -9.65 11.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.323 -0.398 . . . . 61.32 112.055 -176.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.664 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 0.0 OUTLIER -64.5 -27.07 68.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 120.021 -0.671 . . . . 71.540000000000006 110.73 -173.133 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -83.36 -41.12 18.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 110.108 -0.33 . . . . 75.319999999999993 110.108 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -62.59 -42.42 99.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 75.5 111.836 -177.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.664 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 24.3 ptp -68.25 -29.84 68.75 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.085 -0.709 . . . . 71.420000000000002 109.085 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.557 ' HG2' HD22 ' A' ' 77' ' ' LEU . 52.5 mtp -75.86 -36.31 59.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.161 -0.927 . . . . 72.329999999999998 110.92 178.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.53 -31.76 72.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 75.519999999999996 111.001 -165.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.683 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 17.6 p90 -97.02 -11.98 23.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.222 -0.445 . . . . 71.340000000000003 110.984 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.415 ' HD1' ' HA ' ' B' ' 269' ' ' TYR . 2.5 m-30 -60.48 -47.66 85.18 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 110.135 -0.32 . . . . 51.329999999999998 110.135 177.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.568 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -49.68 -45.73 49.08 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.672 -0.694 . . . . 70.340000000000003 110.231 174.135 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -92.1 26.06 2.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.86 -1.064 . . . . 65.519999999999996 111.698 -169.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.683 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 3.6 mmp_? -97.87 -46.79 5.81 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.729 -0.607 . . . . 65.109999999999999 111.455 -177.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.76 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -89.64 10.78 21.88 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.329 -0.548 . . . . 74.430000000000007 110.547 -178.575 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.441 ' HE3' ' HG2' ' A' ' 70' ' ' MET . 29.4 ttmt -60.32 -53.94 51.59 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.702 -0.681 . . . . 74.209999999999994 110.454 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.52 -40.88 96.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 71.319999999999993 111.492 -176.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 60.5 mtm -73.74 -29.78 62.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 52.140000000000001 110.663 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 4.8 tt -72.6 -43.68 63.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 75.109999999999999 109.507 177.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.54 -27.86 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.815 -0.63 . . . . 72.430000000000007 110.821 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.4 57.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 52.200000000000003 111.548 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -95.39 -8.36 35.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.227 0.536 . . . . 74.099999999999994 110.274 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 20.6 mmt -73.74 178.06 5.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.619 -0.719 . . . . 75.310000000000002 111.226 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.748 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 40.4 mt-10 70.09 -5.22 1.34 Allowed 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 113.998 1.111 . . . . 63.350000000000001 113.998 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.28 -68.5 0.34 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.116 0.417 . . . . 73.420000000000002 110.586 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -60.4 -28.72 68.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.848 0.356 . . . . 71.349999999999994 110.832 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.748 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 61.9 mt -64.53 -55.04 23.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.564 . . . . 71.120000000000005 111.628 -176.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.7 pt-20 -63.12 -25.95 68.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.907 0.384 . . . . 75.030000000000001 111.29 -177.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -97.27 5.62 49.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.191 -0.459 . . . . 65.430000000000007 111.196 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -54.99 -52.85 61.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.648 0.24 . . . . 64.25 111.648 -176.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -62.76 -25.85 68.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.638 0.256 . . . . 65.5 111.249 -177.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -66.83 -56.22 11.36 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.411 -0.588 . . . . 55.310000000000002 109.411 175.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 291' ' ' TYR . . . . . 0.678 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 34.7 m-85 -65.83 -35.1 79.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.143 -0.48 . . . . 74.319999999999993 111.287 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -66.29 -22.96 66.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.08 -0.509 . . . . 73.510000000000005 110.119 178.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -87.14 -32.41 19.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.055 -0.52 . . . . 75.340000000000003 110.782 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 23.4 p -84.18 -6.3 59.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.143 -0.48 . . . . 75.319999999999993 111.407 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.678 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 54.4 mt-30 -74.61 161.19 29.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.471 0.653 . . . . 43.32 111.012 175.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 296' ' ' LYS . . . . . 0.716 ' HE2' ' HA ' ' B' ' 296' ' ' LYS . 9.8 mmpt? . . . . . 0 C--O 1.25 1.093 0 CA-C-N 114.84 -1.073 . . . . 65.120000000000005 109.307 -177.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.846 0.355 . . . . 74.120000000000005 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -76.02 -39.74 55.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.262 0.553 . . . . 74.319999999999993 110.155 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -127.94 126.6 41.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.704 -0.68 . . . . 72.140000000000001 110.075 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.94 99.88 9.34 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 54.149999999999999 110.607 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 48.3 t30 72.59 -60.77 0.52 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.333 -0.848 . . . . 72.200000000000003 111.537 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.1 154.55 29.28 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.892 -0.595 . . . . 34.049999999999997 111.65 -176.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.513 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -79.13 51.24 1.14 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.961 -1.018 . . . . 63.530000000000001 112.608 -175.787 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -54.03 -41.22 67.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.854 0.359 . . . . 72.040000000000006 111.154 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -4.77 34.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 35.43 112.361 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.46 ' NH2' ' HB3' ' B' ' 221' ' ' GLN . 60.7 mtp85 -99.86 -61.1 1.41 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.214 -0.291 . . . . 72.140000000000001 110.214 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.874 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.43 -22.49 12.73 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.77 0.656 . . . . 73.219999999999999 112.77 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.4 t -63.18 -22.71 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.706 0.289 . . . . 71.109999999999999 111.153 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.51 ' HB2' HD11 ' B' ' 217' ' ' LEU . 74.6 mt-10 -90.39 -28.08 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.075 0.464 . . . . 74.439999999999998 110.004 -178.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.874 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.8 mm? -62.39 -42.62 99.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 65.409999999999997 110.097 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.01 -23.21 21.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.506 -0.77 . . . . 73.030000000000001 111.093 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -64.22 -28.98 70.11 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 116.15 -0.477 . . . . 74.150000000000006 111.065 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 213' ' ' GLU . 2.1 tm? -74.52 -43.23 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.438 -0.579 . . . . 63.219999999999999 109.438 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.28 75.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.965 -0.562 . . . . 62.439999999999998 111.416 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -66.45 -18.38 65.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.431 -0.349 . . . . 65.019999999999996 111.768 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -77.24 -23.63 51.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.431 0.634 . . . . 72.420000000000002 109.864 177.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -99.23 -11.91 20.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.733 -0.667 . . . . 73.040000000000006 110.07 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.859 ' HA ' HG21 ' A' ' 32' ' ' VAL . 15.3 t-20 -86.57 -21.44 26.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.495 -0.775 . . . . 63.340000000000003 110.064 -177.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -80.67 18.94 0.87 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.185 -0.462 . . . . 74.329999999999998 111.998 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.74 107.2 15.19 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.121 -1.066 . . . . 63.43 108.121 174.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -59.64 -32.38 70.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.807 0.669 . . . . 63.009999999999998 112.807 -171.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -91.44 11.77 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.768 0.655 . . . . 73.340000000000003 112.768 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.2 mt -120.52 152.07 23.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.022 0.439 . . . . 65.219999999999999 110.7 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.677 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 47.0 mt-30 -73.65 152.9 40.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 73.340000000000003 110.143 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.443 HG23 HD22 ' A' ' 22' ' ' ASN . 13.5 m -65.25 -34.15 77.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.206 0.527 . . . . 74.430000000000007 110.841 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.1 -2.43 78.19 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.954 -0.566 . . . . 74.150000000000006 113.708 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.677 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 52.5 mm-40 -86.47 -12.03 50.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.502 0.651 . . . . 54.340000000000003 110.246 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.859 HG21 ' HA ' ' A' ' 22' ' ' ASN . 21.3 t -91.74 -36.88 8.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.793 -0.64 . . . . 73.239999999999995 111.181 -176.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.9 p -58.65 -31.39 68.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 62.030000000000001 110.955 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.11 79.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.796 -0.638 . . . . 62.43 111.274 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.8 m -66.65 -36.38 82.42 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.123 0.487 . . . . 63.310000000000002 110.051 -178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CD1' HD12 ' B' ' 214' ' ' LEU . 8.6 t80 -67.86 -35.54 78.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.761 -0.654 . . . . 62.119999999999997 109.509 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.597 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 11.5 ttt -66.48 -55.83 13.75 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.368 -0.833 . . . . 73.450000000000003 111.644 -178.304 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.62 ' CZ3' ' HB3' ' B' ' 276' ' ' MET . 16.7 t-105 -55.2 -41.1 71.53 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.283 -0.417 . . . . 73.299999999999997 111.142 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.454 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -60.72 -36.64 79.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.244 -0.434 . . . . 61.130000000000003 111.059 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.718 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.9 tp -69.69 -35.97 75.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 72.349999999999994 110.271 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.68 -49.92 75.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.774 -0.648 . . . . 32.109999999999999 111.306 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -80.21 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.51 -0.476 . . . . 70.310000000000002 111.297 -176.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -86.25 -39.49 16.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.402 -0.592 . . . . 75.299999999999997 109.402 175.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -72.81 -30.5 64.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 75.219999999999999 111.116 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.608 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -72.37 -17.06 61.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 72.219999999999999 111.104 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -56.14 -38.19 70.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.846 -0.616 . . . . 72.450000000000003 110.373 177.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.553 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 69.7 m-85 -76.17 -11.31 59.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.734 -0.666 . . . . 72.219999999999999 112.072 -177.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.43 -33.55 85.07 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.394 -0.908 . . . . 63.039999999999999 111.484 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.712 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 60.2 p -60.76 -37.86 83.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.98 0.419 . . . . 71.209999999999994 111.493 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.6 t -95.07 13.98 23.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.149 0.5 . . . . 51.350000000000001 110.842 -175.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.1 t -76.36 -39.26 54.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 75.010000000000005 111.728 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.664 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -140.07 -167.67 2.36 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.481 -0.487 . . . . 73.019999999999996 112.258 -176.418 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.65 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.0 pt-20 -104.59 -40.33 6.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.373 -0.831 . . . . 54.409999999999997 111.686 -174.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.5 p -118.02 162.64 17.83 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.877 -0.416 . . . . 70.219999999999999 109.877 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.61 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 18.4 ptmt -71.66 -35.33 70.32 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.642 -0.423 . . . . 72.040000000000006 110.797 -177.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -64.93 -42.84 94.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.31 -0.405 . . . . 72.219999999999999 111.118 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.548 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 88.2 mt-30 -77.18 -36.1 55.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.886 0.374 . . . . 73.340000000000003 110.36 178.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.712 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 15.9 ttt -63.25 -40.28 96.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.046 -0.525 . . . . 71.129999999999995 110.687 177.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.522 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.2 tt0 -62.11 -33.74 75.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.713 -0.676 . . . . 63.119999999999997 111.053 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.51 -1.61 38.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.353 -0.385 . . . . 53.240000000000002 111.421 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.664 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.9 mmmt -108.77 -0.38 19.98 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.408 -0.36 . . . . 71.430000000000007 111.413 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.624 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.0 ptpt -57.51 -50.81 71.86 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 123.3 0.375 . . . . 72.329999999999998 110.535 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.624 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -75.43 -14.17 60.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.428 -0.351 . . . . 75.519999999999996 110.623 -176.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -82.73 -44.86 15.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 73.5 111.431 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 3.9 ptt? -79.75 -22.49 43.17 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 119.914 -0.714 . . . . 73.140000000000001 109.617 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.475 ' HG2' HD22 ' B' ' 277' ' ' LEU . 56.9 mtp -89.44 -7.9 54.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.589 -0.732 . . . . 71.329999999999998 110.587 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -57.68 -45.47 85.56 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.166 0.508 . . . . 72.239999999999995 110.808 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.657 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 7.1 p90 -110.52 6.06 21.71 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.377 -0.829 . . . . 74.310000000000002 110.333 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.559 ' O ' ' HE1' ' B' ' 237' ' ' MET . 0.8 OUTLIER -63.16 -53.67 49.7 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.217 -0.66 . . . . 71.549999999999997 109.217 173.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.473 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -55.88 -45.2 78.63 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.092 -0.706 . . . . 74.329999999999998 109.092 174.228 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.412 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 7.5 t70 -96.84 57.08 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.852 -1.067 . . . . 61.310000000000002 110.93 -173.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 7.8 mmm180 -122.29 -46.57 2.17 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 120.999 0.428 . . . . 73.310000000000002 110.648 172.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.774 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -92.25 12.56 21.98 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.49 0.662 . . . . 70.019999999999996 109.455 -178.529 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.564 ' HG3' ' SD ' ' B' ' 270' ' ' MET . 65.0 tttt -60.63 -63.82 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.463 -1.244 . . . . 72.140000000000001 110.658 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.27 -37.4 83.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.057 -0.52 . . . . 62.119999999999997 111.289 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.478 ' HB3' ' CZ3' ' B' ' 238' ' ' TRP . 47.3 mtm -69.05 -31.5 70.32 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 74.209999999999994 110.407 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.538 HD22 ' HG2' ' B' ' 266' ' ' MET . 5.6 tt -73.56 -42.14 62.04 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.549 -0.537 . . . . 61.350000000000001 109.549 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.619 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 23.1 t70 -61.53 -35.27 77.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.818 -0.628 . . . . 64.109999999999999 110.329 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.32 -13.72 62.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.444 -0.798 . . . . 53.350000000000001 111.523 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -100.61 -21.38 15.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.071 0.462 . . . . 64.510000000000005 109.759 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.521 ' O ' HG13 ' A' ' 85' ' ' ILE . 20.8 mmt -68.21 -55.73 11.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.832 -0.622 . . . . 71.219999999999999 110.18 174.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 12.5 pt-20 -57.29 -26.06 60.25 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 115.556 -0.747 . . . . 75.099999999999994 111.278 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -53.04 -48.49 67.6 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.042 0.448 . . . . 73.530000000000001 110.409 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -84.15 -25.01 29.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.152 -0.476 . . . . 71.5 110.721 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 81' ' ' MET . 67.5 mt -69.47 -56.87 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 74.25 110.919 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.632 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.1 pt-20 -68.96 -19.74 64.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 53.039999999999999 111.163 -176.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -103.95 18.88 21.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.516 -0.311 . . . . 74.129999999999995 111.174 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 21.4 t80 -56.84 -54.67 43.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.98 -0.378 . . . . 72.420000000000002 109.98 177.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -72.89 1.87 7.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.372 -0.376 . . . . 74.299999999999997 111.399 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -90.09 -52.59 4.87 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.833 -0.803 . . . . 72.340000000000003 108.833 173.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -70.73 -28.23 64.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.411 0.624 . . . . 74.430000000000007 110.391 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.537 ' HA ' ' HG2' ' A' ' 95' ' ' GLN . 1.2 tmm_? -77.75 -13.8 59.79 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.776 -0.647 . . . . 73.230000000000004 109.676 178.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -89.44 -25.54 21.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.688 -0.687 . . . . 75.420000000000002 110.569 177.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.9 p -87.85 -4.37 58.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.193 0.521 . . . . 71.230000000000004 110.818 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.537 ' HG2' ' HA ' ' A' ' 92' ' ' ARG . 11.5 pt20 -109.45 176.37 5.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 73.150000000000006 110.498 177.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm . . . . . 0 C--N 1.322 -0.605 0 CA-C-N 115.745 -0.661 . . . . 74.150000000000006 110.384 -178.111 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.233 0.54 . . . . 71.530000000000001 110.247 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -100.0 4.97 45.13 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.58 -0.736 . . . . 63.420000000000002 109.795 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -150.15 134.17 16.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.347 -0.842 . . . . 63.009999999999998 109.997 -176.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 204' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 36.2 tt0 -78.93 81.55 5.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.129 -0.487 . . . . 71.409999999999997 110.854 -178.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 72.64 -60.94 0.52 Allowed 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 124.107 0.963 . . . . 72.519999999999996 110.658 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -73.12 160.54 31.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.809 -0.632 . . . . 73.329999999999998 111.648 -176.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -82.25 49.47 1.42 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.338 -0.846 . . . . 73.140000000000001 111.805 -177.362 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.419 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 67.0 m-85 -53.21 -45.63 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.094 0.473 . . . . 54.409999999999997 110.735 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.97 -18.17 64.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.463 -0.79 . . . . 73.010000000000005 112.212 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.625 HH22 HG22 ' A' ' 32' ' ' VAL . 25.4 mtp180 -90.41 -62.27 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.156 -0.313 . . . . 63.149999999999999 110.156 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.823 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -54.16 -26.75 29.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.091 0.775 . . . . 63.409999999999997 113.091 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.5 t -65.58 -18.32 65.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.509 0.195 . . . . 75.310000000000002 111.188 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 21.2 mt-10 -96.49 -16.73 20.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.062 0.458 . . . . 73.150000000000006 110.391 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.823 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.9 mm? -69.11 -45.01 71.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.888 -0.782 . . . . 72.299999999999997 108.888 173.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.444 HG13 ' HB1' ' A' ' 39' ' ' ALA . 66.7 mt -69.2 -24.85 28.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.394 -0.821 . . . . 74.109999999999999 110.339 175.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.7 tmtp? -59.69 -35.71 75.03 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.678 -0.692 . . . . 72.329999999999998 110.709 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.75 HD12 HD13 ' A' ' 14' ' ' LEU . 3.0 tm? -71.41 -42.35 68.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.185 -0.672 . . . . 74.530000000000001 109.185 176.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.59 -39.07 86.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 75.230000000000004 111.04 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -61.22 -33.77 74.03 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.849 0.357 . . . . 74.310000000000002 111.074 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -34.78 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 74.209999999999994 110.459 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 221' ' ' GLN . . . . . 0.46 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 56.3 mt-30 -82.77 -17.34 44.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.364 0.602 . . . . 73.329999999999998 110.255 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 222' ' ' ASN . . . . . 0.518 ' HA ' HG21 ' B' ' 232' ' ' VAL . 8.8 t30 -76.25 -5.47 47.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.154 -0.93 . . . . 75.329999999999998 109.779 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -77.41 2.37 16.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 73.209999999999994 111.356 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.43 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -58.7 131.99 52.54 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.099 0.476 . . . . 71.299999999999997 110.262 175.721 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.8 t -94.69 -22.96 17.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.834 -0.621 . . . . 73.420000000000002 110.063 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 226' ' ' GLU . . . . . 0.468 ' HG2' HG13 ' B' ' 227' ' ' ILE . 1.5 pm0 -88.73 -21.82 23.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.65 -0.704 . . . . 71.530000000000001 111.455 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.468 HG13 ' HG2' ' B' ' 226' ' ' GLU . 6.3 mt -110.01 150.95 12.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.873 0.368 . . . . 75.420000000000002 110.619 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -93.44 175.56 6.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.836 -0.62 . . . . 54.509999999999998 110.193 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 3.4 m -64.29 -31.56 72.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.156 -0.474 . . . . 71.530000000000001 111.588 -175.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.553 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -61.5 -25.62 65.41 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 114.865 0.706 . . . . 71.5 114.865 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -88.06 -15.99 34.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.697 0.748 . . . . 63.420000000000002 111.635 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 232' ' ' VAL . . . . . 0.518 HG21 ' HA ' ' B' ' 222' ' ' ASN . 35.9 t -81.11 -37.4 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.963 -0.295 . . . . 64.099999999999994 110.896 -176.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 8.7 p -60.25 -34.64 73.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.286 0.565 . . . . 53.109999999999999 110.567 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.11 -32.02 72.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.751 . . . . 60.32 111.635 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 18.3 m -67.64 -32.81 73.76 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.137 0.494 . . . . 71.409999999999997 109.738 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.655 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 4.7 t80 -71.91 -34.81 69.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 74.329999999999998 109.239 177.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.774 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.9 tpt -60.41 -55.81 29.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 74.010000000000005 110.916 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.513 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 28.3 t-105 -63.87 -33.8 76.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.73 -0.668 . . . . 75.549999999999997 111.739 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.459 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.99 -39.61 93.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.597 -0.274 . . . . 63.299999999999997 111.16 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.462 HD21 ' HG3' ' A' ' 37' ' ' MET . 61.6 tp -68.19 -29.94 68.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.931 0.396 . . . . 74.340000000000003 110.416 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.09 -47.47 82.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.933 -0.576 . . . . 64.140000000000001 111.303 -178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -84.01 -5.97 59.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.846 -0.342 . . . . 65.150000000000006 110.902 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -89.37 -41.03 12.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.231 -0.655 . . . . 74.109999999999999 109.231 175.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -75.18 -36.73 61.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.791 -0.64 . . . . 72.239999999999995 111.761 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.409 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -68.01 -17.14 64.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.061 0.457 . . . . 71.340000000000003 111.021 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -68.05 -17.82 64.51 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 72.349999999999994 110.009 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -96.71 -0.06 48.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.124 -0.489 . . . . 75.040000000000006 111.206 177.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 248' ' ' GLY . . . . . 0.402 ' HA3' ' SD ' ' A' ' 81' ' ' MET . . . -75.8 -29.77 58.78 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.6 -0.81 . . . . 34.450000000000003 111.671 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 18.6 p -72.11 -18.12 61.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.865 0.365 . . . . 61.240000000000002 111.235 -177.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 15.3 t -103.95 16.79 25.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.538 0.685 . . . . 64.239999999999995 110.117 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 10.6 t -82.06 -44.21 16.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.585 -0.734 . . . . 72.200000000000003 110.329 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.724 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 0.4 OUTLIER -138.94 -172.37 3.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.471 -0.331 . . . . 61.539999999999999 111.159 -179.602 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -102.96 -44.57 5.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.109999999999999 111.592 -173.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 56.4 p -107.33 151.63 25.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.72 -0.218 . . . . 64.019999999999996 110.551 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.471 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 22.5 ptmt -63.27 -32.51 73.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.4 . . . . 65.530000000000001 110.636 -178.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -60.14 -54.17 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.859 -0.609 . . . . 62.520000000000003 110.299 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.665 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 96.4 mt-30 -71.4 -42.88 67.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.838 -0.619 . . . . 72.019999999999996 110.363 -178.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 14.5 ttt -57.27 -42.06 80.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 50.210000000000001 111.233 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -63.23 -33.02 74.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.061 -0.518 . . . . 72.519999999999996 111.245 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -78.3 -4.51 48.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.992 0.425 . . . . 44.43 111.061 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.724 ' HE2' ' HE2' ' B' ' 252' ' ' PHE . 27.1 mmmt -112.91 3.83 16.51 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.156 -176.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.651 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 17.3 ptpt -55.86 -52.97 62.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.073 -0.512 . . . . 54.130000000000003 110.647 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.651 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 5.5 tp-100 -66.57 -30.55 70.88 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.529 -0.305 . . . . 70.400000000000006 110.789 -176.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.437 -0.347 . . . . 75.120000000000005 111.53 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.533 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 4.8 ptt? -79.47 -28.13 41.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 120.274 -0.57 . . . . 54.240000000000002 110.191 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.619 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 72.8 mtp -77.32 -24.24 50.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.718 -0.674 . . . . 44.140000000000001 111.613 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -66.19 -25.95 67.17 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.53 0.681 . . . . 50.130000000000003 109.214 -174.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 28.1 m-85 -94.29 -17.24 22.83 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.893 -1.048 . . . . 55.149999999999999 111.35 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.485 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.5 m-30 -72.55 -40.45 66.7 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.247 -1.02 . . . . 63.539999999999999 108.247 171.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.564 ' SD ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.75 -63.61 1.09 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.033 -0.531 . . . . 74.209999999999994 110.386 169.701 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -98.84 76.87 2.19 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.742 0.645 . . . . 74.109999999999999 112.742 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 4.5 mmm180 -152.87 -34.49 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.955 -0.566 . . . . 71.310000000000002 111.081 166.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.597 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.84 0.66 46.62 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 108.988 -0.745 . . . . 74.150000000000006 108.988 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -61.29 -52.58 64.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.806 -1.088 . . . . 74.510000000000005 110.827 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -58.91 -38.74 79.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.192 0.52 . . . . 65.209999999999994 111.129 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 276' ' ' MET . . . . . 0.62 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 55.2 mtm -80.34 -24.69 39.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.836 -0.62 . . . . 63.310000000000002 110.427 -177.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.475 HD22 ' HG2' ' A' ' 66' ' ' MET . 4.9 tt -72.42 -43.45 63.84 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.814 -0.81 . . . . 73.409999999999997 108.814 174.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.93 -39.85 75.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.085 -0.962 . . . . 64.439999999999998 110.291 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -61.91 -24.03 66.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.091 -0.958 . . . . 71.340000000000003 112.008 -177.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -98.4 -13.98 20.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.913 0.387 . . . . 64.030000000000001 110.516 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.608 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 16.1 mmt -69.66 -55.21 10.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.934 -0.575 . . . . 74.409999999999997 110.786 178.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.573 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 7.3 pt-20 -78.61 0.76 25.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.942 -0.572 . . . . 64.549999999999997 112.495 -174.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.73 -45.92 92.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.278 0.561 . . . . 71.209999999999994 109.601 173.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -82.37 -19.72 38.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.543 -0.753 . . . . 72.420000000000002 110.471 177.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.545 ' CG1' ' HA ' ' B' ' 282' ' ' GLU . 68.6 mt -71.87 -55.29 13.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 120.905 0.384 . . . . 74.109999999999999 110.572 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -65.78 -18.53 65.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 64.450000000000003 110.937 -178.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 287' ' ' ASN . . . . . 0.42 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 57.8 m-80 -112.32 18.9 18.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.446 -0.343 . . . . 70.519999999999996 111.462 179.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.61 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 26.4 t80 -53.59 -54.6 35.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.699 0.285 . . . . 73.230000000000004 110.833 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -77.36 2.93 14.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.329 -0.396 . . . . 71.239999999999995 111.246 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -88.19 -50.38 6.4 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.647 -0.871 . . . . 75.530000000000001 108.647 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -71.71 -41.86 68.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.643 -0.708 . . . . 73.129999999999995 110.285 177.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.501 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 3.6 tmm_? -70.01 -13.33 62.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.799 -0.637 . . . . 72.400000000000006 110.492 -177.519 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -93.75 -30.12 15.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.131 -0.486 . . . . 53.049999999999997 111.01 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 7.3 p -79.86 -21.42 44.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.581 -0.281 . . . . 65.349999999999994 111.187 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.422 ' HG2' ' HA ' ' B' ' 292' ' ' ARG . 6.8 pt20 -80.8 161.61 24.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.374 -0.375 . . . . 74.409999999999997 110.126 173.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.247 -0.882 . . . . 64.219999999999999 109.899 -174.785 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 110.185 -0.302 . . . . 73.25 110.185 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -76.31 -13.44 60.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.08 0.467 . . . . 44.32 111.002 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -80.27 116.16 20.2 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.133 -0.485 . . . . 63.039999999999999 110.083 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.561 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . 3.3 tm-20 -65.28 -43.96 89.54 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.314 -0.995 . . . . 72.430000000000007 108.314 169.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.635 ' H ' ' HE2' ' A' ' 8' ' ' TYR . 9.1 t30 -148.04 -30.33 0.3 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.906 -1.043 . . . . 64.329999999999998 109.767 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.46 -162.75 1.62 Allowed 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 112.511 0.56 . . . . 71.430000000000007 112.511 -173.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.459 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.6 OUTLIER -71.58 42.33 0.08 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.097 1.359 . . . . 51.219999999999999 114.312 -172.396 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.635 ' HE2' ' H ' ' A' ' 5' ' ' ASN . 75.2 m-85 -57.9 -41.5 82.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 118.009 0.368 . . . . 73.340000000000003 111.469 -176.012 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.46 -18.96 65.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 64.400000000000006 111.913 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -92.93 -52.8 4.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.525 0.194 . . . . 74.129999999999995 111.525 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.812 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.6 -25.02 23.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.552 0.575 . . . . 73.409999999999997 112.552 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.9 t -68.13 -23.0 64.84 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.674 0.273 . . . . 65.319999999999993 111.028 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.6 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.3 mt-10 -79.19 -27.22 42.59 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.361 0.6 . . . . 73.109999999999999 109.392 -178.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.812 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -65.75 -48.98 70.04 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.033 -0.985 . . . . 75.109999999999999 109.597 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.502 HG23 ' HD2' ' B' ' 243' ' ' TYR . 81.4 mt -67.82 -29.44 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.587 -0.733 . . . . 63.520000000000003 110.198 176.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.429 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.3 tmmt? -60.18 -30.5 69.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.732 -0.667 . . . . 63.439999999999998 111.023 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.423 HD12 HD13 ' B' ' 214' ' ' LEU . 3.0 tm? -69.32 -45.23 70.01 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.29 -0.633 . . . . 74.430000000000007 109.29 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -32.27 72.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.636 -0.711 . . . . 64.010000000000005 110.921 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.604 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.6 m-20 -56.01 -35.72 67.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.071 -0.513 . . . . 74.430000000000007 110.624 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.54 -37.95 65.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 72.430000000000007 111.122 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -74.13 -22.36 59.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.918 0.389 . . . . 73.439999999999998 110.849 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -79.71 -12.71 59.79 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.185 0.517 . . . . 71.319999999999993 109.872 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.604 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 78.1 mm-40 -81.9 -4.85 57.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.97 -0.559 . . . . 54.409999999999997 110.328 175.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.573 ' HB3' HG13 ' A' ' 27' ' ' ILE . 0.2 OUTLIER -80.03 135.01 36.26 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.256 0.55 . . . . 70.129999999999995 110.61 -176.706 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.402 ' H ' HG22 ' A' ' 25' ' ' THR . 3.4 t -74.98 -36.39 62.03 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.228 -0.896 . . . . 70.129999999999995 111.84 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.58 -23.56 56.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 74.349999999999994 111.602 -174.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.573 HG13 ' HB3' ' A' ' 24' ' ' ASN . 2.5 mt -97.12 163.43 2.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.867 0.365 . . . . 70.109999999999999 110.262 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -119.8 163.52 17.37 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.845 -0.616 . . . . 72.099999999999994 109.392 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -54.65 -32.21 58.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.933 0.397 . . . . 73.030000000000001 111.509 -176.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.54 -42.21 99.72 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.232 -0.508 . . . . 65.540000000000006 113.473 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HB2' HG22 ' A' ' 27' ' ' ILE . 21.0 mm-40 -73.04 -37.82 66.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.127 0.463 . . . . 72.109999999999999 111.221 -173.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -69.12 -36.99 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.193 0.52 . . . . 73.349999999999994 110.657 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 m -74.94 -40.01 61.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.091 0.472 . . . . 43.310000000000002 110.705 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.95 -30.33 63.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 73.219999999999999 111.867 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.494 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 11.0 p -66.98 -30.75 70.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.6 0.238 . . . . 74.0 110.727 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.548 ' CD1' HD12 ' B' ' 214' ' ' LEU . 4.9 t80 -66.16 -33.58 76.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.16 0.505 . . . . 63.310000000000002 109.772 177.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.544 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.8 ttm -70.54 -47.49 60.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.861 -0.609 . . . . 74.129999999999995 111.104 178.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -63.3 -37.89 89.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.931 0.396 . . . . 72.340000000000003 110.616 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.95 -36.8 84.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.197 -0.456 . . . . 72.120000000000005 111.196 179.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.605 HD21 ' SD ' ' B' ' 237' ' ' MET . 52.3 tp -66.62 -32.4 73.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.001 0.429 . . . . 63.310000000000002 110.022 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -66.91 -46.25 75.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.795 -0.639 . . . . 54.329999999999998 110.704 177.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.3 mtp180 -69.05 -25.11 64.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.896 0.379 . . . . 64.010000000000005 110.949 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.411 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 10.5 t80 -84.29 -45.03 13.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 72.349999999999994 111.057 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -68.51 -28.39 66.96 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.081 0.4 . . . . 54.399999999999999 112.081 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.14 60.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.998 0.428 . . . . 72.420000000000002 111.054 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.411 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 22.3 t90 -66.94 -17.67 65.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.639 0.733 . . . . 72.299999999999997 110.047 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.433 ' CZ ' HG22 ' B' ' 229' ' ' THR . 83.0 m-85 -93.3 0.32 56.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.761 -0.654 . . . . 64.450000000000003 111.156 177.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -73.46 -37.05 53.92 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.454 -0.879 . . . . 25.239999999999998 111.323 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -73.03 -0.21 13.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.954 0.407 . . . . 61.409999999999997 111.574 -177.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.7 t -123.53 17.55 9.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.338 0.59 . . . . 73.230000000000004 109.486 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.9 t -93.93 -31.43 14.29 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.813 -0.63 . . . . 63.509999999999998 110.867 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.712 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -143.29 -174.29 4.17 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 120.947 0.403 . . . . 70.329999999999998 111.368 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.678 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 7.7 pt-20 -98.54 -41.4 7.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.573 -0.74 . . . . 54.32 111.383 -173.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 82.7 p -120.93 161.84 20.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.094 -0.336 . . . . 70.420000000000002 110.094 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 22.2 ptmt -72.88 -34.57 66.78 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.918 -0.313 . . . . 74.230000000000004 110.538 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.14 -31.99 73.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.168 -0.469 . . . . 71.430000000000007 110.386 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.666 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 92.0 mt-30 -90.48 -37.72 13.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.007 -0.542 . . . . 73.150000000000006 110.464 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.462 ' HE2' ' CG1' ' B' ' 285' ' ' ILE . 10.5 ttt -61.81 -42.41 98.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.288 -0.414 . . . . 71.340000000000003 110.988 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.85 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.001 -0.545 . . . . 64.430000000000007 110.991 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.07 -6.73 58.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 51.399999999999999 111.27 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.712 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 30.2 mmmt -108.56 4.37 23.99 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 116.486 -0.325 . . . . 73.409999999999997 110.79 -178.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 65' ' ' MET . 18.3 ptpt -53.72 -45.05 70.35 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.338 0.399 . . . . 75.420000000000002 111.017 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 8.5 tp60 -79.9 -14.18 58.82 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.882 -0.327 . . . . 64.209999999999994 110.654 -176.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -93.37 -6.67 46.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.393 -0.367 . . . . 72.230000000000004 110.929 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 20.5 ptp -106.39 -25.05 12.07 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.323 -0.621 . . . . 74.319999999999993 109.323 169.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.516 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 82.2 mtp -94.02 -0.47 55.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.449 -0.796 . . . . 65.349999999999994 112.498 -175.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.26 -33.08 59.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.7 0.762 . . . . 72.230000000000004 109.34 -175.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.648 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 10.8 m-85 -84.27 -16.14 44.21 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.754 -1.112 . . . . 71.310000000000002 110.913 175.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.63 ' CD2' HD21 ' B' ' 277' ' ' LEU . 13.8 m-30 -73.66 -42.21 61.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.263 -0.426 . . . . 61.299999999999997 109.981 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -74.72 -56.71 4.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.279 -0.569 . . . . 61.140000000000001 109.804 170.485 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -102.67 83.73 2.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.09 -0.504 . . . . 64.310000000000002 112.354 -171.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.648 ' HB2' ' O ' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -164.16 -36.93 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.092 -0.504 . . . . 74.299999999999997 111.059 169.821 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.436 ' HE2' ' HG ' ' B' ' 240' ' ' LEU . 0.1 OUTLIER -86.87 7.84 25.5 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.834 0.826 . . . . 74.230000000000004 108.838 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.429 ' HE2' HE22 ' B' ' 263' ' ' GLN . 47.6 tttm -62.64 -54.52 38.33 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.318 -1.31 . . . . 75.109999999999999 110.172 175.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -58.92 -35.57 73.3 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.147 -0.479 . . . . 72.019999999999996 110.625 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.408 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 50.6 mtt -67.28 -36.75 82.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.617 -0.719 . . . . 74.010000000000005 109.974 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 0.9 OUTLIER -75.47 -40.9 56.8 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.264 -0.88 . . . . 64.0 110.224 -178.442 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.414 ' N ' ' HE1' ' B' ' 266' ' ' MET . 3.8 m-20 -53.71 -38.94 64.78 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.315 0.579 . . . . 72.209999999999994 110.175 174.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -31.57 71.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.038 -0.983 . . . . 61.509999999999998 111.523 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.519 HD21 ' HG2' ' B' ' 242' ' ' ARG . 42.8 m-80 -85.09 -32.5 22.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.741 -0.466 . . . . 75.530000000000001 109.741 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.502 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.6 mmt -62.39 -62.17 1.94 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 61.399999999999999 110.475 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 24.6 mm-40 -54.1 -31.7 52.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 64.420000000000002 111.334 -178.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.45 -46.44 80.34 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.346 0.404 . . . . 60.009999999999998 111.328 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -82.53 -28.98 30.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 60.350000000000001 110.695 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.518 HG21 ' HB2' ' B' ' 259' ' ' GLN . 87.3 mt -67.91 -53.48 30.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 71.439999999999998 111.549 -178.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.4 pt-20 -65.32 -25.69 67.72 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.788 0.328 . . . . 73.319999999999993 111.093 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.8 m-80 -102.83 14.94 30.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.553 -0.294 . . . . 72.349999999999994 111.212 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.545 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 62.1 t80 -53.24 -53.83 45.08 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.025 0.203 . . . . 75.349999999999994 111.328 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -66.53 -30.55 70.89 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.834 0.349 . . . . 73.040000000000006 110.329 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -58.51 -52.18 66.73 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.032 -0.531 . . . . 65.439999999999998 110.232 175.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -70.05 -36.83 75.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.436 0.636 . . . . 74.129999999999995 110.172 177.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 4.2 tmm_? -63.87 -20.69 66.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.316 -0.856 . . . . 75.420000000000002 109.988 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -86.55 -26.73 24.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.107 -0.497 . . . . 63.329999999999998 110.954 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 20.4 p -81.35 -20.76 39.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.411 -0.359 . . . . 70.310000000000002 111.303 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -85.56 159.02 19.98 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.671 -0.492 . . . . 75.109999999999999 109.671 175.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.8 mttm . . . . . 0 C--N 1.319 -0.746 0 CA-C-N 116.222 -0.445 . . . . 74.030000000000001 110.574 -175.371 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.233 0.234 0 CA-C-O 120.844 0.354 . . . . 63.039999999999999 111.069 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 202' ' ' ASN . . . . . 0.661 ' HB2' ' HB2' ' B' ' 209' ' ' ALA . 33.0 m-80 -110.91 10.66 22.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.283 0.563 . . . . 75.200000000000003 109.542 175.249 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -138.2 108.04 6.3 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.718 -0.674 . . . . 75.140000000000001 110.661 -174.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.02 -70.09 0.21 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.484 -0.562 . . . . 65.340000000000003 109.484 170.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -142.56 9.6 1.81 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.903 0.859 . . . . 62.030000000000001 109.124 174.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.586 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -124.58 170.37 10.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 74.530000000000001 111.875 -171.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.494 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -86.59 38.04 0.77 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.423 -0.808 . . . . 75.129999999999995 112.061 -175.64 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.586 ' CE2' ' HB3' ' B' ' 206' ' ' ALA . 65.0 m-85 -52.63 -55.71 20.54 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.687 0.254 . . . . 71.400000000000006 111.687 -177.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 209' ' ' ALA . . . . . 0.661 ' HB2' ' HB2' ' B' ' 202' ' ' ASN . . . -61.69 -18.46 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.066 -0.515 . . . . 70.209999999999994 112.338 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -86.79 -54.49 4.33 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.146 -0.222 . . . . 72.310000000000002 110.662 178.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.651 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.1 -28.32 51.68 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.432 0.53 . . . . 70.129999999999995 112.432 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 12.5 t -70.34 -16.4 62.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 120.759 -0.376 . . . . 64.129999999999995 111.264 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 36.8 mt-10 -82.96 -29.23 29.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.837 -0.801 . . . . 74.209999999999994 108.837 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.0 -44.8 79.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.903 -1.044 . . . . 74.219999999999999 108.95 176.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.62 -27.39 33.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.39 -0.823 . . . . 61.32 110.512 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.0 OUTLIER -57.52 -38.63 74.99 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.259 -0.428 . . . . 40.450000000000003 110.982 -179.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.6 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -70.16 -42.59 72.31 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.224 -0.658 . . . . 71.420000000000002 109.224 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 218' ' ' ALA . . . . . 0.474 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -60.03 -42.43 94.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.058 -0.519 . . . . 63.420000000000002 110.731 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.568 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.4 m-20 -56.24 -34.22 66.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.235 -0.439 . . . . 62.399999999999999 110.587 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.33 -34.08 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.007 -0.542 . . . . 73.349999999999994 111.297 -178.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -75.39 -25.91 58.01 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.213 0.53 . . . . 72.219999999999999 110.495 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 222' ' ' ASN . . . . . 0.427 ' HA ' HG21 ' B' ' 232' ' ' VAL . 59.9 t30 -68.27 -21.4 64.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.51 -0.768 . . . . 72.129999999999995 109.125 177.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 60.1 mm-40 -85.32 0.68 51.27 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.383 -0.826 . . . . 62.340000000000003 111.077 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.718 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 2.4 t-20 -78.01 123.15 26.48 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 109.691 -0.485 . . . . 71.129999999999995 109.691 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.3 t -54.98 -26.01 33.77 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.91 -1.041 . . . . 73.540000000000006 113.434 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -105.08 9.05 34.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.381 0.512 . . . . 73.319999999999993 112.381 -173.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.718 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 6.2 mm -108.16 152.14 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.397 0.618 . . . . 75.239999999999995 111.306 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.548 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 32.8 mt-30 -92.11 152.13 20.07 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.143 -0.935 . . . . 54.030000000000001 108.596 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 229' ' ' THR . . . . . 0.433 HG22 ' CZ ' ' A' ' 47' ' ' PHE . 16.8 m -56.46 -38.22 71.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.922 0.392 . . . . 72.209999999999994 110.755 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.28 -0.18 76.78 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.216 -0.516 . . . . 65.340000000000003 113.964 -176.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.548 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 42.1 mt-10 -90.02 -27.42 19.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.862 0.831 . . . . 71.510000000000005 110.406 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 232' ' ' VAL . . . . . 0.474 HG11 ' O ' ' B' ' 218' ' ' ALA . 12.1 t -76.94 -23.94 15.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.741 -0.663 . . . . 75.200000000000003 110.682 -176.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.5 p -77.46 -32.61 54.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.368 0.604 . . . . 52.039999999999999 109.806 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.71 65.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.529 -0.759 . . . . 50.200000000000003 111.044 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.459 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 16.8 p -66.86 -37.11 83.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.706 0.288 . . . . 53.299999999999997 110.334 177.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.563 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.13 -37.71 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.424 0.631 . . . . 55.140000000000001 109.323 175.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.605 ' SD ' HD21 ' A' ' 40' ' ' LEU . 10.7 tpt -58.07 -59.77 4.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.924 -1.034 . . . . 54.149999999999999 111.006 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.408 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 13.6 t-105 -59.43 -37.14 77.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 74.209999999999994 111.593 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.08 93.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.374 -0.375 . . . . 71.129999999999995 111.34 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.501 HD13 ' HB3' ' A' ' 36' ' ' PHE . 53.7 tp -68.77 -33.52 74.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.29 -0.263 . . . . 75.420000000000002 110.29 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.434 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.51 -35.42 75.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 71.239999999999995 111.104 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 242' ' ' ARG . . . . . 0.519 ' HG2' HD21 ' A' ' 80' ' ' ASN . 34.5 mtp180 -80.44 -45.87 16.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.181 -0.463 . . . . 72.209999999999994 110.742 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.502 ' HD2' HG23 ' A' ' 15' ' ' ILE . 12.2 t80 -68.52 -40.32 80.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.112 -0.495 . . . . 54.450000000000003 111.315 -174.05 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -64.73 -35.09 79.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.159 0.504 . . . . 71.25 110.931 -175.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -68.4 -2.04 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.871 -0.604 . . . . 64.430000000000007 112.242 -177.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -64.16 -26.92 68.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.218 0.532 . . . . 74.129999999999995 110.115 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -81.76 -5.27 58.0 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.134 -0.354 . . . . 75.319999999999993 111.13 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -71.03 -40.55 62.1 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.643 -0.789 . . . . 53.009999999999998 111.999 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 4.5 p -70.04 -14.25 62.59 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.869 0.322 . . . . 54.140000000000001 111.869 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.0 t -111.19 19.68 18.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.364 0.602 . . . . 72.219999999999999 110.022 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 8.2 t -84.94 -43.79 13.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.032 -0.531 . . . . 72.439999999999998 111.29 -176.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.577 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -143.2 -177.65 5.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.362 0.601 . . . . 75.040000000000006 112.353 -176.01 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.498 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 9.6 pt-20 -92.32 -37.03 12.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.973 -1.012 . . . . 74.329999999999998 111.832 -171.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.7 p -126.47 161.28 28.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.38 -0.23 . . . . 62.509999999999998 110.38 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.545 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 17.0 ptmt -64.14 -39.02 93.12 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 70.200000000000003 111.067 -177.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 256' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' B' ' 255' ' ' LYS . 37.1 mt-10 -59.89 -47.4 85.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.088 0.471 . . . . 75.239999999999995 111.026 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.677 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 88.9 mt-30 -80.48 -30.04 37.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.967 -0.56 . . . . 55.43 110.421 -176.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 14.0 ttt -67.03 -45.04 78.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 73.430000000000007 110.398 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.518 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.2 tt0 -63.03 -32.55 73.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.701 -0.681 . . . . 74.340000000000003 111.064 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -72.9 -11.33 60.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.178 -0.464 . . . . 74.239999999999995 111.055 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -107.1 -4.13 19.22 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 110.059 -0.348 . . . . 74.120000000000005 110.059 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.524 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 36.4 ttpt -52.3 -56.29 15.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.761 -0.654 . . . . 65.219999999999999 110.686 -177.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.429 HE22 ' HE2' ' A' ' 74' ' ' LYS . 15.2 tp60 -64.74 -30.92 71.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 75.209999999999994 111.004 -178.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -70.12 -45.48 66.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.329 -0.396 . . . . 74.219999999999999 111.909 -176.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.524 ' CE ' ' HA ' ' B' ' 262' ' ' LYS . 3.0 ptt? -77.73 -24.43 49.12 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 119.734 -0.786 . . . . 54.420000000000002 109.542 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.474 ' HA ' ' CD2' ' B' ' 269' ' ' TYR . 84.5 mtp -79.61 -13.39 59.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.591 -0.731 . . . . 71.219999999999999 111.431 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.17 -30.07 69.1 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.484 -0.932 . . . . 72.030000000000001 108.484 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.469 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 21.8 m-85 -93.7 -10.22 35.12 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.332 -1.304 . . . . 75.209999999999994 111.486 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.474 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 20.2 m-30 -79.82 -40.73 27.91 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.281 -1.007 . . . . 75.439999999999998 108.281 172.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.474 ' N ' ' HE3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.7 -59.01 3.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.087 -0.506 . . . . 53.100000000000001 110.199 170.026 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.16 83.65 2.0 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.168 0.433 . . . . 75.400000000000006 112.168 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 9.7 mmm180 -154.04 -30.02 0.12 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.972 -0.558 . . . . 72.219999999999999 110.903 166.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.544 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -90.52 6.44 43.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.619 -0.882 . . . . 75.099999999999994 108.619 177.039 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.581 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 85.2 tttt -61.82 -53.5 55.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.564 -1.198 . . . . 74.219999999999999 110.248 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 275' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' B' ' 275' ' ' GLU . 5.2 pt-20 -69.41 -33.61 73.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.055 -0.52 . . . . 53.229999999999997 110.9 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.0 mtt -61.62 -38.93 89.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.608 0.718 . . . . 73.430000000000007 109.706 173.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.63 HD21 ' CD2' ' A' ' 69' ' ' TYR . 22.6 tp -71.37 -46.07 61.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.687 -1.142 . . . . 74.140000000000001 110.786 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.96 -40.23 80.07 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.271 0.558 . . . . 75.409999999999997 110.486 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.54 -30.72 71.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.156 -0.929 . . . . 72.510000000000005 111.196 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -86.31 -29.26 23.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 62.310000000000002 110.508 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.568 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -61.26 -55.42 32.11 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.879 -0.415 . . . . 73.310000000000002 109.879 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.611 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 71.7 mm-40 -52.98 -30.63 36.16 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.515 -0.766 . . . . 45.200000000000003 111.799 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -54.52 -51.36 65.39 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.396 0.435 . . . . 72.219999999999999 111.133 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -80.22 -28.65 38.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.356 -0.384 . . . . 75.310000000000002 111.156 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.568 HG13 ' O ' ' B' ' 281' ' ' MET . 76.3 mt -63.98 -53.56 42.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.823 0.344 . . . . 54.509999999999998 110.895 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.9 pt-20 -63.18 -29.01 70.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.42 -0.355 . . . . 51.240000000000002 111.201 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 287' ' ' ASN . . . . . 0.463 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 61.6 m-80 -102.02 15.37 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.528 -0.305 . . . . 71.099999999999994 111.417 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.449 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 27.0 t80 -53.22 -57.6 9.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.683 0.278 . . . . 73.519999999999996 111.02 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -68.07 -21.76 64.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.297 -0.41 . . . . 70.150000000000006 110.583 -175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -65.06 -58.47 5.98 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.667 -0.494 . . . . 71.430000000000007 109.667 176.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -70.19 -35.98 74.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.02 0.438 . . . . 72.439999999999998 111.342 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.562 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 1.5 tmm_? -69.3 -19.85 63.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.056 -0.52 . . . . 73.129999999999995 110.53 -179.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -90.34 -34.29 15.76 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.66 0.267 . . . . 51.229999999999997 110.835 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 5.1 p -70.6 -22.45 62.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.323 -0.399 . . . . 54.049999999999997 111.222 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -88.73 149.29 23.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.16 -0.473 . . . . 53.219999999999999 110.347 175.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 67.4 mttm . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.671 -0.68 . . . . 63.450000000000003 110.175 -178.378 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 N--CA 1.475 0.821 0 CA-C-O 120.835 0.35 . . . . 34.219999999999999 110.408 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.408 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 5.8 m-20 -57.41 -44.69 84.8 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.288 -0.415 . . . . 73.310000000000002 111.023 177.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.667 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.3 p-10 -155.37 144.4 20.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.054 0.454 . . . . 64.120000000000005 110.767 -178.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -83.51 -80.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.993 -0.549 . . . . 74.019999999999996 110.169 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -105.16 -53.74 2.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.07 0.462 . . . . 74.430000000000007 109.94 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.667 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -82.52 161.9 22.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.895 -0.593 . . . . 71.200000000000003 110.808 177.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.471 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -80.41 55.14 2.19 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.895 -0.593 . . . . 73.209999999999994 112.181 -178.252 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -53.02 -42.65 65.86 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.334 -0.394 . . . . 74.329999999999998 111.844 -176.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' HG22 ' A' ' 12' ' ' THR . . . -63.35 -28.39 69.97 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.136 0.421 . . . . 70.109999999999999 112.136 -176.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -80.81 -62.98 1.51 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 121.174 -0.21 . . . . 74.510000000000005 110.608 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.91 -22.41 10.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.778 0.659 . . . . 54.450000000000003 112.778 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 9' ' ' ALA . 1.9 t -70.02 -25.82 63.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.464 0.173 . . . . 64.409999999999997 110.992 -176.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.488 ' CB ' HD11 ' B' ' 217' ' ' LEU . 29.9 mt-10 -76.73 -35.5 57.74 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.373 0.606 . . . . 72.420000000000002 109.401 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.655 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.0 mm? -61.11 -49.81 75.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.612 -1.176 . . . . 71.430000000000007 109.694 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.726 HG23 ' HD1' ' B' ' 243' ' ' TYR . 91.2 mt -63.36 -39.84 86.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.616 -0.72 . . . . 63.450000000000003 110.858 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 tmmt? -62.02 -31.37 71.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.618 -0.719 . . . . 74.0 111.516 -176.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.525 HD12 HD13 ' B' ' 214' ' ' LEU . 3.0 tm? -64.68 -42.54 95.28 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.981 -0.748 . . . . 51.43 108.981 177.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.72 -30.79 71.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.403 -0.817 . . . . 41.030000000000001 110.948 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.437 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 4.5 m-20 -62.57 -35.26 78.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.212 -0.449 . . . . 75.310000000000002 110.749 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -70.57 -23.25 62.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.197 -0.456 . . . . 53.229999999999997 111.23 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -88.17 -27.29 21.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.247 0.546 . . . . 75.209999999999994 110.351 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -78.26 0.51 24.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 73.150000000000006 110.33 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 48.8 mt-30 -77.46 -11.81 59.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 74.109999999999999 111.197 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.432 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.5 t-20 -66.04 114.14 4.98 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.462 -0.57 . . . . 75.109999999999999 109.462 178.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.437 ' H ' HG22 ' A' ' 25' ' ' THR . 3.8 t -77.45 58.06 1.64 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.318 -0.856 . . . . 64.239999999999995 112.272 -172.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -178.0 -22.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 75.230000000000004 111.441 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.432 HG13 ' HB3' ' A' ' 24' ' ' ASN . 9.7 mt -84.36 148.77 4.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 72.450000000000003 110.31 -177.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.709 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -72.76 145.38 47.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 61.140000000000001 109.704 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.0 m -63.39 -25.26 68.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.252 0.549 . . . . 75.340000000000003 109.843 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.03 -17.37 78.59 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 115.462 -0.79 . . . . 73.409999999999997 112.823 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.709 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 16.3 mm-40 -79.04 -22.62 45.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.417 0.627 . . . . 74.019999999999996 109.567 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -83.53 -42.44 17.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.417 -0.811 . . . . 74.010000000000005 110.088 179.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 p -62.1 -35.94 80.22 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.988 0.423 . . . . 73.140000000000001 110.177 176.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.13 -33.33 75.75 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.978 -0.555 . . . . 75.409999999999997 110.786 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.7 m -68.46 -36.35 78.88 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.509 -0.552 . . . . 72.519999999999996 109.509 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.655 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.7 t80 -69.94 -35.05 74.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.472 -0.785 . . . . 63.219999999999999 109.49 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' MET . . . . . 1.013 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.8 tpt -62.35 -56.79 14.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.08 -0.964 . . . . 73.030000000000001 110.563 179.128 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.406 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.637 -0.71 . . . . 72.140000000000001 111.335 177.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.05 99.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.404 -0.362 . . . . 60.420000000000002 111.102 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.9 -38.51 91.25 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 110.021 -0.362 . . . . 74.219999999999999 110.021 176.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.429 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -61.71 -45.86 92.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.233 -0.439 . . . . 72.129999999999995 111.041 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG3' ' OD1' ' B' ' 280' ' ' ASN . 39.9 ttt180 -74.27 -18.69 60.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.383 -0.371 . . . . 74.319999999999993 110.923 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.482 ' HD2' HG23 ' B' ' 215' ' ' ILE . 14.2 t80 -90.57 -35.35 15.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.136 0.494 . . . . 75.25 110.346 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -74.85 -39.24 61.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.915 -0.584 . . . . 70.150000000000006 111.185 -175.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.474 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -65.59 -18.21 65.15 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.035 0.445 . . . . 62.439999999999998 111.531 -178.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TRP . . . . . 0.572 ' CH2' HG21 ' B' ' 229' ' ' THR . 16.7 t90 -63.67 -23.68 67.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.652 -0.703 . . . . 73.099999999999994 110.466 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.469 ' O ' HG22 ' A' ' 50' ' ' THR . 42.6 m-85 -93.61 9.71 35.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.219 -0.446 . . . . 72.5 111.075 178.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -76.74 -24.0 68.37 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.093 -1.051 . . . . 71.230000000000004 110.633 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.982 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 14.8 m -72.38 -12.96 61.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.186 -0.507 . . . . 71.450000000000003 111.843 -177.677 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.8 t -104.14 6.77 35.98 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.292 0.568 . . . . 75.099999999999994 110.612 -178.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.6 m -86.77 -24.78 24.96 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 112.935 0.717 . . . . 62.32 112.935 -175.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.547 ' HD1' ' H ' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -150.72 -172.31 4.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 122.095 -0.378 . . . . 63.049999999999997 111.22 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.547 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 9.6 pt-20 -110.85 -35.61 5.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.223 -0.444 . . . . 64.109999999999999 112.197 -173.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.3 p -115.15 155.56 26.9 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.094 -0.336 . . . . 53.210000000000001 110.094 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.631 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 21.9 ptmt -66.65 -37.93 85.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.738 0.304 . . . . 62.509999999999998 110.816 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -69.69 -27.67 65.21 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.07 -0.514 . . . . 73.120000000000005 111.32 -174.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.617 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 96.8 mt-30 -94.05 -32.47 13.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.448 -0.342 . . . . 74.549999999999997 110.652 178.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.982 ' HE1' ' HA ' ' A' ' 49' ' ' SER . 16.6 ttp -72.57 -35.53 67.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.991 0.424 . . . . 74.010000000000005 110.497 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.57 ' HB2' HG21 ' B' ' 285' ' ' ILE . 35.2 tt0 -62.1 -37.55 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 75.140000000000001 110.654 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.69 -2.2 25.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.912 -0.585 . . . . 71.209999999999994 110.998 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 32.1 mmmt -110.81 0.39 17.26 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 116.32 -0.4 . . . . 74.230000000000004 110.953 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.76 ' HG3' ' H ' ' A' ' 63' ' ' GLN . 12.9 ptpt -54.97 -56.9 14.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.836 0.35 . . . . 62.240000000000002 110.367 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.76 ' H ' ' HG3' ' A' ' 62' ' ' LYS . 5.7 tp-100 -74.49 -20.13 60.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.249 -0.432 . . . . 73.030000000000001 109.843 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -79.69 -36.26 37.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.754 -0.657 . . . . 74.340000000000003 111.434 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 20.8 ptp -79.27 -27.01 42.29 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.112 -1.069 . . . . 55.049999999999997 108.112 178.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.42 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 76.7 mtp -79.36 -17.46 54.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.864 -1.062 . . . . 65.439999999999998 110.477 175.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -58.56 -35.01 71.68 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.318 0.58 . . . . 53.219999999999999 110.819 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.745 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 14.8 p90 -108.92 -5.69 16.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.75 -0.659 . . . . 75.109999999999999 110.576 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.683 ' HD2' HD21 ' B' ' 277' ' ' LEU . 2.2 m-30 -60.52 -51.95 67.27 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 110.469 -0.197 . . . . 75.349999999999994 110.469 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . 1.038 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.25 -43.36 70.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.629 0.728 . . . . 75.450000000000003 109.599 172.924 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.0 33.98 0.86 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.798 -1.092 . . . . 71.25 112.066 -171.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.745 ' HG3' ' O ' ' A' ' 68' ' ' TYR . 35.2 mtp180 -105.85 -43.2 4.94 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.626 -0.671 . . . . 71.140000000000001 110.958 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.829 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -91.57 6.93 43.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.817 -0.353 . . . . 74.239999999999995 111.127 -175.179 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -60.88 -53.16 60.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 74.200000000000003 110.461 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -57.52 -34.32 68.99 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.192 0.52 . . . . 60.229999999999997 110.882 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.8 mtt -68.28 -37.1 80.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 74.430000000000007 109.922 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.557 ' HB3' ' CE ' ' B' ' 266' ' ' MET . 0.4 OUTLIER -73.0 -43.4 62.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.194 -0.912 . . . . 75.120000000000005 110.407 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.417 ' N ' ' HE1' ' B' ' 266' ' ' MET . 3.3 m-20 -55.31 -39.02 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.449 0.643 . . . . 74.239999999999995 110.634 178.156 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.69 -22.49 53.88 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.121 -0.945 . . . . 75.409999999999997 112.269 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.478 ' OD1' ' HG3' ' B' ' 242' ' ' ARG . 20.2 m-80 -94.29 -8.67 38.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.446 -0.502 . . . . 63.409999999999997 111.854 -174.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.456 ' HE3' ' HA ' ' B' ' 245' ' ' ALA . 44.2 mtt -88.94 -175.24 4.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.216 0.532 . . . . 74.120000000000005 111.278 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.665 ' HA ' HD12 ' A' ' 85' ' ' ILE . 36.2 mt-10 69.8 -5.1 1.29 Allowed 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.668 -1.151 . . . . 62.020000000000003 113.207 177.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.02 -56.97 15.1 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.074 0.464 . . . . 74.329999999999998 110.703 178.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -73.78 -21.73 60.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 55.32 110.904 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.7 mt -67.52 -57.79 8.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.404 -0.362 . . . . 65.120000000000005 110.407 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 23.9 pt-20 -62.8 -26.43 68.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 72.019999999999996 111.292 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -98.49 1.45 46.67 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.996 0.369 . . . . 41.210000000000001 111.996 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -59.23 -40.57 86.29 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.981 -0.377 . . . . 62.25 109.981 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -51.3 -47.42 62.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.62 -0.718 . . . . 74.340000000000003 109.962 174.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -68.69 -53.04 24.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.191 -0.913 . . . . 61.310000000000002 110.911 -175.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -57.95 -43.8 86.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.156 0.503 . . . . 63.229999999999997 111.652 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -74.95 -11.09 60.04 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.757 -0.656 . . . . 74.519999999999996 110.609 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -96.06 -33.73 12.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.776 0.322 . . . . 43.340000000000003 111.17 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 16.4 p -73.16 -19.71 61.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.386 -0.37 . . . . 70.319999999999993 111.6 -178.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -90.76 169.57 10.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.152 -0.477 . . . . 65.319999999999993 110.429 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.3 mttm . . . . . 0 C--N 1.319 -0.755 0 CA-C-N 115.916 -0.583 . . . . 73.540000000000006 110.588 -174.877 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 C--O 1.233 0.221 0 CA-C-O 121.708 0.766 . . . . 63.109999999999999 109.825 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -141.95 172.44 12.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.085 -0.961 . . . . 71.510000000000005 109.213 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.562 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.0 p-10 -76.03 156.51 33.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 110.111 -0.329 . . . . 62.119999999999997 110.111 178.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -85.69 -113.49 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.418 -0.356 . . . . 72.439999999999998 110.512 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -91.89 -13.7 30.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.857 0.837 . . . . 50.25 109.184 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -107.55 150.44 26.85 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.101 -0.954 . . . . 61.140000000000001 110.471 176.351 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.455 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.1 OUTLIER -76.14 50.93 0.64 Allowed 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.939 -1.028 . . . . 63.240000000000002 112.486 -177.905 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.473 ' CZ ' ' HB3' ' B' ' 206' ' ' ALA . 63.5 m-85 -53.87 -44.28 70.26 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.725 0.298 . . . . 73.519999999999996 111.536 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -72.08 -9.04 57.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.147 -0.479 . . . . 74.129999999999995 111.86 -175.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 74.1 mtt180 -99.08 -59.31 1.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.928 -0.397 . . . . 71.450000000000003 109.928 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.736 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.12 -23.72 22.41 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.868 0.692 . . . . 71.209999999999994 112.868 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 9.3 t -65.05 -25.43 67.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.499 0.185 . . . . 74.439999999999998 111.499 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.484 ' HB2' HD11 ' A' ' 17' ' ' LEU . 39.1 mt-10 -80.52 -26.39 38.13 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.359 0.6 . . . . 61.210000000000001 109.845 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.736 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.2 mm? -68.18 -47.77 67.07 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.061 -0.972 . . . . 75.230000000000004 109.341 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.482 HG23 ' HD2' ' A' ' 43' ' ' TYR . 82.1 mt -66.5 -33.01 60.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-N 115.839 -0.619 . . . . 63.229999999999997 110.415 175.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.436 ' HE2' ' HB3' ' B' ' 216' ' ' LYS . 5.0 tmmm? -57.84 -36.37 72.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.529 -0.76 . . . . 73.049999999999997 110.797 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.488 HD11 ' CB ' ' A' ' 13' ' ' GLU . 2.5 tm? -66.95 -41.68 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.668 -0.493 . . . . 74.25 109.668 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.39 -31.74 69.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 64.549999999999997 110.94 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -59.79 -33.32 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.141 -0.481 . . . . 62.149999999999999 111.12 178.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.06 -24.75 47.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.126 -0.488 . . . . 72.209999999999994 111.764 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -91.01 -17.06 26.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.395 0.617 . . . . 74.319999999999993 110.114 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -85.92 8.79 18.98 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.259 -0.882 . . . . 74.129999999999995 110.257 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -84.18 10.05 11.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.947 -0.569 . . . . 71.540000000000006 111.217 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -88.41 108.27 19.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.955 0.407 . . . . 73.209999999999994 110.763 177.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -74.39 -25.23 59.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.725 -0.671 . . . . 70.040000000000006 110.885 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -82.2 -6.0 58.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.355 -0.384 . . . . 74.510000000000005 111.781 -176.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.743 HG22 ' H ' ' B' ' 228' ' ' GLN . 2.4 mt -124.12 179.7 2.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.84 -0.43 . . . . 74.129999999999995 109.84 -178.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.743 ' H ' HG22 ' B' ' 227' ' ' ILE . 2.3 mp0 -103.82 158.39 16.42 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.822 -0.436 . . . . 52.420000000000002 109.822 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 229' ' ' THR . . . . . 0.572 HG21 ' CH2' ' A' ' 46' ' ' TRP . 25.4 m -67.08 -16.44 64.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.212 0.53 . . . . 72.420000000000002 110.656 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -62.85 -33.36 86.78 Favored Glycine 0 CA--C 1.521 0.449 0 CA-C-N 115.603 -0.726 . . . . 70.230000000000004 113.733 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -72.45 -26.89 62.0 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 117.573 0.687 . . . . 71.349999999999994 110.6 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.7 t -72.06 -46.76 57.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.138 -0.483 . . . . 75.200000000000003 110.129 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 3.2 p -62.49 -34.52 77.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 61.32 110.366 176.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -69.81 -35.9 75.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.912 -0.585 . . . . 72.530000000000001 111.255 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 59.8 m -67.04 -35.38 79.74 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.09 0.471 . . . . 44.399999999999999 109.889 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' A' ' 14' ' ' LEU . 8.5 t80 -67.47 -38.71 84.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.734 -0.666 . . . . 64.340000000000003 109.69 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.829 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.6 ttm -65.97 -48.22 71.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.539 -0.755 . . . . 72.140000000000001 111.42 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.471 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 17.3 t-105 -61.15 -40.53 94.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 71.530000000000001 110.463 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.558 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.76 -42.16 99.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.882 -0.599 . . . . 55.43 110.997 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.725 HD21 ' SD ' ' A' ' 37' ' ' MET . 49.6 tp -60.75 -40.52 92.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 71.510000000000005 110.741 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.4 95.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.099 -0.501 . . . . 64.010000000000005 110.671 178.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 242' ' ' ARG . . . . . 0.478 ' HG3' ' OD1' ' A' ' 80' ' ' ASN . 64.3 ttt180 -67.08 -32.57 73.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.572 -0.74 . . . . 74.420000000000002 110.608 -179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.726 ' HD1' HG23 ' A' ' 15' ' ' ILE . 23.0 t80 -77.52 -40.06 44.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 65.340000000000003 110.992 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -73.2 -24.49 60.53 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.772 0.286 . . . . 74.420000000000002 111.772 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.493 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -68.55 -19.77 64.51 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.247 0.546 . . . . 74.400000000000006 110.958 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.1 t90 -59.88 -33.46 71.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.241 -0.89 . . . . 64.200000000000003 111.054 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -72.84 -6.52 45.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.854 -0.612 . . . . 61.299999999999997 112.502 -171.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -59.8 -30.99 70.47 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.011 -1.09 . . . . 64.140000000000001 110.916 172.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.515 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 6.6 m -66.36 -16.29 63.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.724 0.41 . . . . 74.140000000000001 111.741 -177.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -116.43 17.33 15.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.067 0.46 . . . . 35.340000000000003 110.808 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 39.8 t -81.34 -56.55 3.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.031 -0.531 . . . . 71.230000000000004 110.655 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 5.2 m-85 -137.69 178.76 6.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.083 0.468 . . . . 74.340000000000003 112.188 -177.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 8.9 pt-20 -94.76 -33.75 12.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.36 -0.836 . . . . 75.209999999999994 110.985 -173.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.425 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 75.4 p -114.21 154.34 28.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.242 -0.435 . . . . 72.349999999999994 110.211 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.505 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 21.3 ptmt -70.03 -29.8 66.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.816 0.341 . . . . 74.439999999999998 110.292 -178.215 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 256' ' ' GLU . . . . . 0.425 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.9 mp0 -55.17 -48.43 73.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.685 -0.689 . . . . 44.219999999999999 110.415 177.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.702 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 92.1 mt-30 -80.54 -41.82 23.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.73 -0.668 . . . . 75.420000000000002 109.986 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.515 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.1 ttt -55.18 -44.51 75.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.602 -0.726 . . . . 74.109999999999999 111.483 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.569 ' HA ' HD13 ' A' ' 85' ' ' ILE . 36.0 tt0 -64.75 -40.98 96.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.515 . . . . 73.140000000000001 111.432 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.74 -5.96 33.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 53.409999999999997 111.685 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.702 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 27.6 mmmt -106.75 4.73 27.98 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.247 -0.279 . . . . 72.450000000000003 110.247 -177.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.474 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.6 ptpt -51.38 -46.0 62.66 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.431 0.457 . . . . 71.019999999999996 110.788 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.474 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 5.1 tp-100 -84.27 -18.03 37.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.766 0.317 . . . . 75.329999999999998 110.521 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -85.24 -30.56 23.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.525 . . . . 70.540000000000006 111.26 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -81.75 -29.0 33.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.342 -0.984 . . . . 51.329999999999998 108.342 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.557 ' CE ' ' HB3' ' A' ' 77' ' ' LEU . 71.9 mtp -87.87 11.23 16.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.864 -1.062 . . . . 53.32 110.462 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -75.0 -38.03 61.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 74.219999999999999 111.027 -177.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.595 ' HA ' ' OD2' ' B' ' 271' ' ' ASP . 42.7 p90 -114.07 -4.21 13.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.884 -0.598 . . . . 61.420000000000002 110.818 -175.26 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.434 ' O ' ' HE1' ' A' ' 37' ' ' MET . 3.6 m-30 -56.68 -52.46 64.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 121.02 -0.272 . . . . 73.420000000000002 110.607 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 270' ' ' MET . . . . . 1.038 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.55 -50.85 52.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.619 0.574 . . . . 71.329999999999998 110.888 177.773 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 271' ' ' ASP . . . . . 0.595 ' OD2' ' HA ' ' B' ' 268' ' ' TYR . 2.9 p30 -85.47 22.07 1.63 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.643 . . . . 74.129999999999995 112.647 -171.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 33.3 mtp180 -82.03 -34.98 29.29 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.539 -0.464 . . . . 71.430000000000007 110.259 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 1.013 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.7 12.93 34.14 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.445 -0.502 . . . . 54.229999999999997 109.75 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.467 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 86.5 tttt -58.49 -54.87 42.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.726 -0.67 . . . . 55.310000000000002 110.261 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.38 -31.76 72.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.573 -0.739 . . . . 74.349999999999994 111.281 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 58.2 mtt -71.49 -36.28 71.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.927 -0.579 . . . . 61.130000000000003 110.389 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.683 HD21 ' HD2' ' A' ' 69' ' ' TYR . 38.0 tp -70.35 -41.21 73.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.292 -0.867 . . . . 71.219999999999999 110.127 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -60.9 -45.26 95.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.782 -0.644 . . . . 75.430000000000007 110.408 178.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -66.26 -17.08 64.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.239 -0.891 . . . . 63.240000000000002 112.235 -176.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 280' ' ' ASN . . . . . 0.402 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 36.4 m-80 -102.13 -2.08 30.14 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.879 -0.328 . . . . 73.299999999999997 111.392 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.474 ' HG2' ' HB1' ' A' ' 45' ' ' ALA . 46.2 mtt -91.54 -177.25 4.75 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.862 -0.335 . . . . 73.319999999999993 110.428 174.128 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.732 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 46.1 mt-10 67.38 -3.36 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.67 -0.696 . . . . 72.239999999999995 112.598 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.29 -58.75 5.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.07 0.462 . . . . 74.439999999999998 110.398 176.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -84.96 -3.13 58.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.778 -0.646 . . . . 72.420000000000002 110.996 177.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.732 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 63.1 mt -85.01 -59.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.724 0.297 . . . . 73.120000000000005 110.437 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -67.11 -18.44 65.31 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.968 0.413 . . . . 70.109999999999999 110.561 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -107.01 6.92 29.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 75.430000000000007 111.011 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 60.7 t80 -59.19 -48.89 79.93 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.852 -0.425 . . . . 74.400000000000006 109.852 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -63.87 -31.51 72.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.566 -0.743 . . . . 45.310000000000002 110.443 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -66.78 -56.83 8.69 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.78 -0.645 . . . . 71.430000000000007 110.29 177.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 291' ' ' TYR . . . . . 0.476 ' O ' ' HG2' ' B' ' 295' ' ' GLN . 62.5 m-85 -64.83 -40.77 95.73 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.915 0.388 . . . . 75.209999999999994 110.979 -176.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.59 ' HB2' ' O ' ' B' ' 288' ' ' PHE . 0.2 OUTLIER -67.64 -18.32 64.91 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.862 -0.608 . . . . 74.439999999999998 110.94 -178.248 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -95.55 -29.86 14.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.226 -0.443 . . . . 71.019999999999996 111.078 -179.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 16.7 p -75.55 -10.22 59.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.052 0.453 . . . . 72.349999999999994 111.234 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' B' ' 291' ' ' TYR . 10.7 pt20 -117.73 171.21 8.19 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.971 -0.559 . . . . 73.140000000000001 109.981 176.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 68.4 mttm . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.416 -0.802 . . . . 74.230000000000004 109.823 -177.136 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.3 p . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 121.248 0.547 . . . . 74.439999999999998 110.861 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -124.51 -66.16 1.0 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.825 -0.625 . . . . 70.450000000000003 109.453 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.4 p-10 -158.21 136.56 10.94 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.422 -0.955 . . . . 51.240000000000002 108.422 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -84.14 -66.06 0.94 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.732 0.301 . . . . 71.209999999999994 111.416 -174.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -124.22 -41.44 2.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.457 -0.571 . . . . 74.239999999999995 109.457 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.76 157.25 31.79 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.551 -0.75 . . . . 74.540000000000006 110.635 177.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.502 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.31 43.41 0.72 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.092 -0.958 . . . . 64.099999999999994 112.468 -175.122 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -52.48 -51.42 59.44 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.885 0.374 . . . . 73.439999999999998 111.589 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.412 ' H ' ' HB3' ' A' ' 3' ' ' ASN . . . -69.35 -5.57 24.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 53.340000000000003 111.759 -177.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.502 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 27.6 mmt180 -100.72 -58.88 1.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.313 -0.254 . . . . 75.530000000000001 110.313 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.739 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -52.19 -25.54 9.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.462 0.542 . . . . 62.520000000000003 112.462 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -62.89 -24.77 67.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.61 -0.268 . . . . 74.519999999999996 111.062 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.0 mt-10 -86.24 -28.96 23.5 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-O 121.108 0.48 . . . . 73.510000000000005 110.024 -178.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.739 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -64.26 -47.15 80.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.587 -0.733 . . . . 70.219999999999999 109.613 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.427 HG13 ' HB1' ' B' ' 239' ' ' ALA . 62.0 mt -69.51 -28.45 37.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.931 -0.577 . . . . 64.530000000000001 110.275 176.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 13' ' ' GLU . 2.7 mmmt -63.91 -28.69 70.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.543 . . . . 72.299999999999997 111.296 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.617 HD12 HD13 ' B' ' 214' ' ' LEU . 2.7 tm? -78.27 -31.13 48.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.259 -0.645 . . . . 62.210000000000001 109.259 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.75 -44.06 74.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.719 -0.673 . . . . 71.319999999999993 109.404 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.515 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 6.5 m-20 -58.21 -27.66 64.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.27 -0.877 . . . . 73.109999999999999 110.643 175.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -75.27 -32.39 61.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 75.239999999999995 110.813 -176.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -86.24 -20.4 28.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.426 0.632 . . . . 74.239999999999995 109.75 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -74.09 -10.05 59.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.142 -0.935 . . . . 73.409999999999997 109.574 176.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 80.3 mt-30 -77.48 -10.29 59.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.557 -0.747 . . . . 73.439999999999998 110.799 177.54 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -71.26 103.9 2.97 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.076 -0.713 . . . . 75.230000000000004 109.076 178.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -46.8 -44.73 19.45 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.528 0.936 . . . . 72.120000000000005 113.528 -173.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.57 -4.02 54.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.321 0.489 . . . . 74.540000000000006 112.321 -173.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.6 mt -104.0 151.4 6.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.649 -0.5 . . . . 71.140000000000001 109.649 177.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -98.97 160.15 14.46 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.177 -0.465 . . . . 74.049999999999997 110.382 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.08 -33.4 65.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.935 -0.575 . . . . 70.219999999999999 110.744 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.74 -33.65 83.55 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.484 -0.78 . . . . 54.100000000000001 113.828 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -74.63 -26.25 59.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.734 0.767 . . . . 73.439999999999998 110.365 -174.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -76.16 -32.84 23.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.671 -0.695 . . . . 75.040000000000006 110.305 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.577 ' O ' ' HG3' ' A' ' 37' ' ' MET . 92.1 p -72.4 -12.59 61.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.293 -0.412 . . . . 70.299999999999997 110.258 177.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -90.86 -39.72 12.16 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.121 -0.491 . . . . 73.230000000000004 110.798 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.45 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 5.6 p -67.41 -31.01 70.93 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.162 0.506 . . . . 74.340000000000003 110.276 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.644 ' HB3' HD13 ' B' ' 240' ' ' LEU . 2.6 t80 -68.52 -29.38 67.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 71.349999999999994 110.378 178.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.658 ' HG2' HD21 ' B' ' 240' ' ' LEU . 51.0 mtp -77.52 -45.69 24.71 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.719 -0.219 . . . . 75.340000000000003 110.635 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.0 t-105 -60.67 -38.92 86.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 74.439999999999998 110.138 176.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.454 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.49 -47.89 77.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.584 -0.735 . . . . 63.119999999999997 110.926 177.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.595 HD21 ' HG2' ' B' ' 237' ' ' MET . 51.2 tp -63.25 -40.5 97.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.714 0.292 . . . . 50.439999999999998 110.514 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.507 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -54.69 -46.68 74.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.765 -0.652 . . . . 51.119999999999997 111.496 -178.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -13.13 51.35 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.211 -0.595 . . . . 74.439999999999998 110.97 -177.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -80.94 -35.08 32.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.028 -0.73 . . . . 73.010000000000005 109.028 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -67.73 -35.13 78.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.888 -0.596 . . . . 65.099999999999994 109.535 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.579 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -71.83 -17.81 62.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.656 -0.702 . . . . 72.109999999999999 111.529 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.2 t90 -63.4 -22.54 66.94 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.17 0.51 . . . . 75.109999999999999 110.224 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -89.32 -4.07 58.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 71.040000000000006 111.373 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.99 -37.69 60.27 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.603 -0.808 . . . . 32.229999999999997 112.124 -179.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.474 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 33.5 p -67.48 -23.18 65.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.895 0.379 . . . . 74.109999999999999 111.441 -176.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.9 t -100.19 11.28 39.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.15 0.5 . . . . 73.219999999999999 110.278 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 t -85.88 -29.53 23.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.422 -0.354 . . . . 54.299999999999997 110.685 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.834 ' HE2' ' HE3' ' A' ' 61' ' ' LYS . 0.3 OUTLIER -145.46 -175.21 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.208 0.447 . . . . 72.409999999999997 112.208 -179.721 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.54 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.7 pt-20 -99.1 -32.28 11.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.418 -0.81 . . . . 72.430000000000007 112.162 -172.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.54 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.6 p -128.59 156.79 42.8 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 116.241 -0.436 . . . . 65.040000000000006 109.911 -178.096 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.624 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.6 ptmm? -69.05 -27.52 65.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.842 0.353 . . . . 72.239999999999995 110.641 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -63.45 -49.15 74.79 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.875 -0.602 . . . . 74.310000000000002 110.294 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.639 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 97.0 mt-30 -79.71 -36.97 36.69 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.813 -0.63 . . . . 62.310000000000002 110.31 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.484 ' HE1' HG12 ' B' ' 285' ' ' ILE . 14.3 ttt -60.2 -40.42 90.03 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.04 -0.527 . . . . 62.539999999999999 111.219 178.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.666 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.3 tt0 -63.7 -30.86 71.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.027 -0.533 . . . . 73.140000000000001 111.231 -177.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.67 -9.23 59.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.04 0.448 . . . . 50.039999999999999 111.042 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.834 ' HE3' ' HE2' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -105.0 -5.46 20.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.213 -0.449 . . . . 71.510000000000005 110.338 -176.809 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HD2' ' N ' ' A' ' 63' ' ' GLN . 0.6 OUTLIER -51.86 -54.91 23.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 61.130000000000003 110.866 -177.603 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.506 ' N ' ' HD2' ' A' ' 62' ' ' LYS . 11.0 tp60 -75.31 -13.13 60.4 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.098 -0.501 . . . . 75.409999999999997 110.687 -175.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -87.55 -32.87 19.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.477 -0.328 . . . . 73.329999999999998 111.032 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.7 ptp -81.79 -26.73 34.17 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.497 -0.927 . . . . 52.130000000000003 108.497 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.557 ' HE3' ' HB3' ' B' ' 277' ' ' LEU . 71.6 mtp -83.3 -9.85 58.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.054 -0.975 . . . . 64.219999999999999 110.508 175.048 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 30.1 t70 -66.53 -18.13 65.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.996 -0.547 . . . . 73.120000000000005 111.153 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.501 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 26.6 p90 -124.63 -0.69 8.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.048 -0.524 . . . . 73.409999999999997 110.637 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.586 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 1.5 m-30 -66.79 -56.85 8.61 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 121.352 -0.139 . . . . 54.229999999999997 111.045 -178.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.877 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -46.55 -54.26 9.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.122 0.487 . . . . 74.230000000000004 110.363 174.812 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -81.6 17.42 1.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.803 -0.635 . . . . 63.509999999999998 111.771 -174.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.586 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -85.09 -50.2 7.63 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.028 0.442 . . . . 71.209999999999994 110.416 -177.485 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.602 ' HB3' ' HB3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -89.86 10.55 23.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.428 0.633 . . . . 64.140000000000001 109.646 -174.697 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 82.2 tttt -60.96 -49.73 76.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.069 -0.969 . . . . 65.209999999999994 110.735 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -58.95 -41.98 88.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 70.549999999999997 110.906 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 54.0 mtt -64.28 -36.45 84.13 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.653 -0.703 . . . . 73.109999999999999 110.354 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 2.3 tt -74.55 -44.88 48.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.326 -0.852 . . . . 73.420000000000002 110.353 -176.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -60.64 -38.74 85.8 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.327 0.584 . . . . 72.140000000000001 110.313 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.16 -24.64 66.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.196 -0.911 . . . . 74.239999999999995 111.668 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -99.4 -20.68 16.35 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.74 -0.384 . . . . 72.219999999999999 110.429 -178.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.746 ' HE2' ' HA ' ' B' ' 245' ' ' ALA . 16.5 mmt -61.67 -63.85 1.13 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.079 -0.51 . . . . 75.200000000000003 110.503 174.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.606 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 35.7 mt-10 -71.53 -7.34 47.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.074 -0.512 . . . . 75.239999999999995 111.479 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.89 -46.24 75.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.711 -0.477 . . . . 72.019999999999996 109.711 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -73.3 -35.64 66.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.05 -0.523 . . . . 73.120000000000005 110.268 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.606 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 86.5 mt -61.49 -54.27 37.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.853 -0.612 . . . . 54.420000000000002 111.655 -178.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.2 pt-20 -63.9 -19.56 65.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.822 0.344 . . . . 64.319999999999993 111.355 -177.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -104.95 6.87 33.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.466 -0.333 . . . . 74.239999999999995 111.093 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 84.3 t80 -60.97 -38.75 87.06 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.468 -0.567 . . . . 64.549999999999997 109.468 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.65 -45.75 81.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.325 -0.852 . . . . 52.520000000000003 109.347 175.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -62.81 -54.23 42.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.096 -0.956 . . . . 73.120000000000005 110.912 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -63.73 -35.42 80.51 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.84 0.311 . . . . 74.310000000000002 111.84 -177.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -73.45 -14.09 61.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.993 0.425 . . . . 75.230000000000004 110.628 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -93.96 -30.76 14.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.296 -0.411 . . . . 71.450000000000003 110.862 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 20.9 p -79.16 -4.88 52.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.343 0.592 . . . . 74.329999999999998 110.769 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -121.27 176.4 5.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.654 -0.703 . . . . 75.129999999999995 110.202 175.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt . . . . . 0 C--N 1.321 -0.669 0 CA-C-N 115.844 -0.616 . . . . 72.329999999999998 110.329 179.844 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 25.2 m . . . . . 0 C--O 1.235 0.327 0 CA-C-O 120.912 0.387 . . . . 24.239999999999998 110.526 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -123.39 154.87 38.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.133 -0.485 . . . . 74.239999999999995 110.18 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.716 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.3 OUTLIER -100.35 147.77 25.43 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.624 -0.51 . . . . 74.510000000000005 109.624 176.619 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 204' ' ' GLU . . . . . 0.938 ' HG2' ' HE2' ' B' ' 208' ' ' TYR . 1.6 pm0 -60.52 -88.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.139 0.422 . . . . 72.430000000000007 112.139 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -112.26 -40.37 4.18 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.437 -0.505 . . . . 75.319999999999993 110.957 -178.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -81.69 156.66 24.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.176 -0.465 . . . . 70.319999999999993 111.147 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.45 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -76.92 53.4 0.93 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.228 -0.896 . . . . 74.230000000000004 112.259 -178.949 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.938 ' HE2' ' HG2' ' B' ' 204' ' ' GLU . 63.3 m-85 -55.45 -44.25 76.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.71 0.291 . . . . 73.040000000000006 111.314 -178.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.54 -20.46 64.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.073 -0.512 . . . . 34.130000000000003 111.925 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -91.44 -62.58 1.4 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.104 -0.239 . . . . 71.239999999999995 110.686 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.746 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -53.74 -24.06 13.77 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.802 0.667 . . . . 51.329999999999998 112.802 -176.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 11.8 t -65.0 -28.09 69.27 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.672 0.272 . . . . 64.109999999999999 111.161 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.526 ' HB2' HD11 ' A' ' 17' ' ' LEU . 48.3 mt-10 -82.32 -25.23 34.1 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.331 0.586 . . . . 71.340000000000003 109.897 -176.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.746 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.3 mm? -67.04 -44.65 79.69 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.282 -0.872 . . . . 72.030000000000001 108.985 178.149 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.454 HG13 ' HB1' ' A' ' 39' ' ' ALA . 78.1 mt -73.07 -30.45 31.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.494 -0.775 . . . . 61.240000000000002 110.407 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.433 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 39.4 tptt -53.58 -45.53 70.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.765 -0.652 . . . . 75.409999999999997 111.344 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.2 tm? -64.31 -40.01 95.06 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.757 -0.461 . . . . 75.340000000000003 109.757 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -62.13 -27.01 68.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 75.439999999999998 110.973 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 94.7 m-20 -66.58 -31.68 72.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 53.439999999999998 110.65 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 220' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -74.09 -32.24 63.15 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.746 0.308 . . . . 71.439999999999998 111.338 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -82.18 -15.82 51.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.148 0.499 . . . . 72.140000000000001 110.546 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -78.73 -16.08 57.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.839 -0.619 . . . . 65.109999999999999 109.712 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 59.6 mm-40 -85.5 -10.55 55.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.643 -0.708 . . . . 73.109999999999999 109.813 177.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.594 ' OD1' ' HG2' ' B' ' 226' ' ' GLU . 1.2 t-20 -71.55 114.53 9.73 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.147 -0.933 . . . . 70.209999999999994 110.141 -175.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -58.96 -31.61 68.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.47 -0.786 . . . . 72.409999999999997 112.998 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 226' ' ' GLU . . . . . 0.594 ' HG2' ' OD1' ' B' ' 224' ' ' ASN . 12.0 pt-20 -82.69 -7.64 59.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.738 0.304 . . . . 70.430000000000007 111.383 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.582 ' CG2' ' HB2' ' B' ' 231' ' ' GLU . 4.5 mt -113.15 149.12 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.010000000000005 110.419 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -102.68 164.2 11.78 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.534 -0.543 . . . . 65.120000000000005 109.534 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 2.3 m -54.62 -38.51 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.965 0.412 . . . . 54.210000000000001 111.387 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -77.63 -8.74 87.16 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.121 -0.562 . . . . 64.099999999999994 113.663 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.582 ' HB2' ' CG2' ' B' ' 227' ' ' ILE . 5.8 mm-40 -88.72 -33.32 17.56 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.564 0.682 . . . . 72.010000000000005 109.539 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.2 t -71.81 -38.81 66.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.400000000000006 110.272 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 21.4 p -63.5 -43.05 98.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 61.340000000000003 110.4 178.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -70.99 -26.6 63.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.582 . . . . 41.530000000000001 110.866 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.429 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.5 t -66.55 -33.69 76.24 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.562 0.696 . . . . 75.140000000000001 109.158 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.609 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 5.7 t80 -73.38 -28.55 62.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.111 -0.949 . . . . 74.140000000000001 109.842 177.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.602 ' HB3' ' HB3' ' A' ' 73' ' ' TYR . 51.7 mtp -75.64 -46.19 32.96 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.368 -0.378 . . . . 70.349999999999994 110.611 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.409 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 27.2 t-105 -60.85 -40.35 92.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.089 0.471 . . . . 63.240000000000002 110.166 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.427 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.54 -45.56 92.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.609 -0.723 . . . . 54.549999999999997 110.81 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.658 HD21 ' HG2' ' A' ' 37' ' ' MET . 52.1 tp -67.82 -38.41 83.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.895 0.379 . . . . 64.209999999999994 110.511 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.565 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -56.87 -49.58 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.794 -0.639 . . . . 63.310000000000002 111.472 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -86.78 6.37 31.85 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.072 -0.651 . . . . 72.319999999999993 110.887 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -99.63 -36.66 9.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.838 -0.801 . . . . 71.129999999999995 108.838 172.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.35 -39.02 85.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.822 -0.626 . . . . 53.219999999999999 109.575 173.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.746 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -67.21 -16.55 64.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.614 -0.721 . . . . 72.409999999999997 111.732 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -58.86 -34.97 72.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 72.340000000000003 110.858 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -76.53 -2.94 34.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 71.230000000000004 111.777 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -67.27 -30.08 75.07 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.55 -0.833 . . . . 61.200000000000003 111.26 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.0 p -63.89 -22.18 66.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.954 0.407 . . . . 73.140000000000001 111.262 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.9 t -111.91 18.27 18.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.325 -0.398 . . . . 73.519999999999996 110.73 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 9.7 t -81.32 -39.79 24.61 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.771 -0.455 . . . . 71.5 109.771 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.863 ' HE2' ' HE3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -149.17 -174.63 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 74.010000000000005 111.213 179.153 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.472 ' HG3' ' N ' ' B' ' 254' ' ' THR . 12.9 pt-20 -90.34 -50.84 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.774 -0.648 . . . . 65.239999999999995 112.061 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.472 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 80.6 p -107.56 164.06 12.54 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 110.444 -0.206 . . . . 74.129999999999995 110.444 -176.393 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.556 ' HB2' HG23 ' A' ' 85' ' ' ILE . 22.6 ptmt -65.61 -33.48 76.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.766 0.317 . . . . 60.43 110.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.18 -45.8 83.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.99 -0.55 . . . . 73.230000000000004 111.072 -177.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 257' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -87.66 -7.11 57.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.134 -0.485 . . . . 64.530000000000001 111.21 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 9.9 ttt -93.29 -41.5 9.83 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.318 0.58 . . . . 75.209999999999994 109.959 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.536 ' HA ' HD13 ' A' ' 85' ' ' ILE . 44.4 tt0 -56.27 -42.48 77.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.199 -0.909 . . . . 74.439999999999998 111.171 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.29 -5.73 24.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.459 -0.791 . . . . 51.030000000000001 111.83 -176.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.863 ' HE3' ' HE2' ' B' ' 252' ' ' PHE . 0.1 OUTLIER -109.93 5.24 22.24 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.434 -0.348 . . . . 62.539999999999999 110.65 -175.696 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.594 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 13.5 ptpt -51.04 -47.59 61.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 64.209999999999994 111.399 -178.01 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.594 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 4.7 tp-100 -78.89 -11.97 60.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.566 -0.288 . . . . 73.230000000000004 111.05 -173.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.89 -43.23 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.669 -0.241 . . . . 71.109999999999999 111.294 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' B' ' 265' ' ' MET . 2.7 ptt? -76.81 -30.03 56.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.77 -0.772 . . . . 75.209999999999994 109.382 176.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.54 ' HG2' HD22 ' A' ' 77' ' ' LEU . 62.4 mtp -88.39 16.39 6.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.805 -0.634 . . . . 72.099999999999994 110.41 177.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 267' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 20.7 t70 -90.01 -36.49 14.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.136 0.493 . . . . 64.329999999999998 109.696 175.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.409 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 39.8 p90 -107.72 -14.53 14.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.983 -0.553 . . . . 72.329999999999998 111.544 -174.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -57.17 -60.72 3.18 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 121.018 -0.273 . . . . 73.219999999999999 110.533 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.877 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.07 -45.39 52.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.645 0.736 . . . . 62.020000000000003 110.181 175.935 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -84.26 9.01 14.04 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.088 -0.96 . . . . 74.040000000000006 112.052 -170.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 2.9 mtm180 -88.39 -41.4 12.84 Favored 'General case' 0 CA--C 1.513 -0.453 0 O-C-N 121.834 -0.541 . . . . 73.209999999999994 110.648 -176.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.581 ' HB3' ' HB3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -94.79 7.48 45.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.509 0.671 . . . . 73.310000000000002 109.268 -175.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 79.5 tttt -61.54 -57.16 13.2 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.688 -1.142 . . . . 73.329999999999998 111.14 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.4 -32.6 74.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.703 0.287 . . . . 74.329999999999998 110.882 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 63.8 mtt -60.93 -41.12 95.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.481 0.658 . . . . 53.329999999999998 109.509 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.557 ' HB3' ' HE3' ' A' ' 66' ' ' MET . 0.9 OUTLIER -69.49 -41.87 75.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.147 -0.933 . . . . 65.019999999999996 109.73 179.08 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.76 -41.45 86.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.543 -0.753 . . . . 72.200000000000003 110.611 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.9 -20.87 59.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.255 -0.884 . . . . 75.319999999999993 112.034 -177.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -92.25 -24.68 18.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.676 -0.41 . . . . 72.120000000000005 110.556 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.579 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 18.3 mmt -58.98 -59.3 5.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.916 -0.584 . . . . 72.219999999999999 110.69 174.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.591 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.9 mt-10 -63.57 -20.99 66.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.595 -0.73 . . . . 72.430000000000007 112.336 -174.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.92 -48.72 77.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.176 0.512 . . . . 71.299999999999997 110.139 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -77.07 -25.32 52.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.005 -0.543 . . . . 74.109999999999999 110.445 178.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.666 HD13 ' HA ' ' A' ' 59' ' ' GLN . 63.4 mt -71.03 -56.31 11.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.095 -0.502 . . . . 62.009999999999998 111.279 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -64.4 -28.21 69.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.739 0.304 . . . . 74.530000000000001 111.64 -176.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -91.71 3.21 55.63 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.99 -0.284 . . . . 72.25 111.087 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.624 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 80.4 t80 -59.14 -39.78 83.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.85 -0.159 . . . . 74.349999999999994 110.935 -179.388 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -58.91 -31.57 68.75 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.079 0.466 . . . . 71.010000000000005 110.212 178.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -74.72 -49.27 21.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.776 -0.647 . . . . 73.120000000000005 109.75 176.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -60.09 -39.38 85.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.915 -0.584 . . . . 71.219999999999999 111.455 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -72.29 -15.6 61.9 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.993 -0.549 . . . . 65.349999999999994 110.681 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.57 -29.35 16.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.951 0.405 . . . . 62.240000000000002 111.034 -178.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 10.1 p -80.21 -15.09 57.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.132 0.491 . . . . 71.530000000000001 111.415 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -111.89 170.52 8.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.146 -0.479 . . . . 72.409999999999997 110.906 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? . . . . . 0 C--O 1.251 1.152 0 CA-C-N 115.309 -0.86 . . . . 71.230000000000004 109.62 179.626 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.473 0.706 0 CA-C-O 121.067 0.461 . . . . 74.25 110.209 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -132.02 163.43 28.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.981 -0.554 . . . . 75.239999999999995 109.784 -177.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.5 p-10 -97.28 145.79 25.75 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.844 0.354 . . . . 74.209999999999994 110.178 -178.08 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.432 ' HB3' ' H ' ' A' ' 5' ' ' ASN . 9.4 tp10 -79.5 -86.37 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.416 -0.587 . . . . 75.349999999999994 109.416 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.432 ' H ' ' HB3' ' A' ' 4' ' ' GLU . 23.6 t30 -113.09 -42.71 3.49 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.765 -0.828 . . . . 71.420000000000002 108.765 170.32 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -71.81 154.12 41.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.271 -0.877 . . . . 71.109999999999999 111.972 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.487 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -77.77 57.07 1.6 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.239 -1.346 . . . . 74.310000000000002 111.954 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.436 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 67.3 m-85 -54.75 -40.91 69.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.315 -0.402 . . . . 63.439999999999998 111.802 -178.244 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.74 -16.18 61.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 65.019999999999996 111.655 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -87.33 -60.91 1.84 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.532 -0.304 . . . . 73.109999999999999 110.389 176.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.795 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -61.53 -16.74 50.5 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.887 0.699 . . . . 53.130000000000003 112.887 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.552 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 14.7 t -65.05 -30.44 71.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.035 -0.266 . . . . 53.32 111.016 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.541 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.2 mt-10 -81.6 -26.36 34.96 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.167 0.508 . . . . 74.430000000000007 110.151 -176.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.795 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.6 mm? -63.6 -41.67 98.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.543 -0.753 . . . . 73.430000000000007 109.804 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.497 HG23 ' HD2' ' B' ' 243' ' ' TYR . 69.1 mt -72.71 -22.74 20.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.609 -0.723 . . . . 70.019999999999996 110.688 178.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 12' ' ' THR . 30.7 mmmt -64.42 -34.57 78.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.564 -0.289 . . . . 74.109999999999999 111.024 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -63.13 -37.27 86.55 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.009 -0.737 . . . . 75.510000000000005 109.009 177.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.47 71.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.657 -0.701 . . . . 74.049999999999997 110.491 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.52 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 12.1 m-80 -59.96 -43.53 95.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.762 -0.654 . . . . 63.509999999999998 110.553 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -65.46 -35.23 80.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.769 -0.651 . . . . 73.239999999999995 111.436 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.37 -27.21 41.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 72.409999999999997 110.633 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -79.88 -0.91 36.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.316 0.579 . . . . 73.409999999999997 110.288 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 94.4 mt-30 -75.16 -8.85 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.034 -0.53 . . . . 72.319999999999993 109.982 174.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -78.93 156.14 28.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.323 -0.853 . . . . 75.540000000000006 110.1 175.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.2 t -128.46 -14.78 4.66 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.131 0.491 . . . . 61.119999999999997 109.922 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -83.94 -2.73 57.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.563 -0.744 . . . . 64.319999999999993 110.303 174.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.2 mt -122.86 149.28 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 108.829 -0.804 . . . . 55.130000000000003 108.829 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.722 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -77.8 150.68 34.25 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.813 0.339 . . . . 64.530000000000001 110.391 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -61.3 -31.4 71.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.288 0.566 . . . . 72.109999999999999 109.771 174.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.712 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -68.08 -22.14 74.07 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.495 -0.775 . . . . 65.120000000000005 113.296 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.722 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 11.3 mm-40 -74.24 -34.25 63.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.334 0.588 . . . . 73.420000000000002 109.69 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.5 t -69.43 -44.61 79.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.592 -0.731 . . . . 73.120000000000005 110.534 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.421 ' HB3' ' CE1' ' B' ' 243' ' ' TYR . 15.1 p -65.29 -39.43 92.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.096 -0.502 . . . . 71.340000000000003 110.709 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.95 -35.01 79.79 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.847 -0.615 . . . . 64.329999999999998 110.383 177.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.538 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 52.5 m -63.83 -40.26 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.847 0.356 . . . . 73.409999999999997 110.096 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.703 ' HD1' HD12 ' B' ' 214' ' ' LEU . 10.4 t80 -62.06 -40.53 96.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.362 0.601 . . . . 64.310000000000002 109.737 177.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.676 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.4 ttm -67.14 -45.44 77.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.582 -0.736 . . . . 72.219999999999999 111.612 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.604 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 18.8 t-105 -64.61 -35.79 82.16 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.986 0.422 . . . . 72.030000000000001 110.568 177.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.447 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.74 -39.39 93.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.134 -0.485 . . . . 61.020000000000003 110.657 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 56.4 tp -65.62 -35.6 81.3 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.466 -0.334 . . . . 71.239999999999995 110.161 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.3 -44.13 95.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 71.519999999999996 110.809 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.23 -35.68 66.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.175 -0.466 . . . . 62.310000000000002 110.627 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.406 ' HE1' ' OG ' ' B' ' 233' ' ' SER . 9.9 t80 -73.7 -33.51 64.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 63.420000000000002 110.786 -177.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 6.8 t-20 -76.09 -35.71 59.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.083 0.468 . . . . 41.299999999999997 110.767 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.73 -15.1 63.3 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.913 -0.585 . . . . 74.450000000000003 111.311 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -59.29 -35.82 74.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.714 -0.676 . . . . 74.540000000000006 111.428 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.526 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.3 m-85 -71.44 -9.08 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.402 -0.363 . . . . 62.200000000000003 111.888 -176.535 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -29.56 64.31 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.349 -0.929 . . . . 62.25 111.294 175.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.526 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 50.2 p -61.44 -32.77 72.75 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.709 0.29 . . . . 53.530000000000001 111.652 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -103.1 16.86 25.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.185 0.517 . . . . 71.200000000000003 110.695 -176.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.29 -47.34 24.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.167 -0.469 . . . . 72.150000000000006 110.72 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.457 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.9 OUTLIER -142.68 -175.11 4.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.32 0.581 . . . . 71.25 112.297 -176.929 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -99.09 -28.06 13.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.916 -1.038 . . . . 61.119999999999997 111.679 -173.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.2 p -127.56 160.01 32.88 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.14 -0.482 . . . . 55.539999999999999 110.302 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.592 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 19.5 ptmt -68.92 -38.01 79.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.548 -0.296 . . . . 75.349999999999994 111.19 -177.132 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -30.2 71.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.502 -0.317 . . . . 74.420000000000002 111.415 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -92.29 -29.12 16.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.031 0.443 . . . . 63.009999999999998 110.557 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.526 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 17.8 ttt -69.73 -43.8 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.724 -0.671 . . . . 73.340000000000003 110.778 178.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.625 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.1 tt0 -62.62 -33.47 75.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.699 -0.682 . . . . 71.140000000000001 111.639 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.02 -23.75 64.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.095 0.474 . . . . 74.310000000000002 111.133 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.3 mmmt -89.32 -0.36 57.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.917 -0.583 . . . . 63.240000000000002 110.777 -174.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.588 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 10.0 ptpp? -51.75 -47.16 64.2 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 123.597 0.561 . . . . 73.040000000000006 110.491 -175.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.588 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 5.4 tp-100 -86.15 -21.92 27.3 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.085 -0.507 . . . . 65.540000000000006 110.214 -175.182 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.4 ' OE2' ' HD2' ' A' ' 61' ' ' LYS . 48.8 mt-10 -73.41 -40.54 64.19 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.601 -0.727 . . . . 63.149999999999999 110.837 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.4 ptp -79.26 -27.58 42.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.257 0.551 . . . . 63.329999999999998 109.584 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 62' ' ' LYS . 90.2 mtp -78.71 -17.33 56.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.813 -0.63 . . . . 65.400000000000006 110.915 177.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -60.63 -31.27 70.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.196 0.522 . . . . 35.43 111.345 -172.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -108.65 -10.43 15.2 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.598 -0.441 . . . . 72.140000000000001 111.005 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.531 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 5.4 m-30 -58.7 -53.94 52.74 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.623 0.249 . . . . 75.5 111.088 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.696 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -50.97 -53.63 31.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.254 0.55 . . . . 75.239999999999995 110.725 175.825 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.569 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 4.2 t70 -89.5 32.53 0.86 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.394 -0.821 . . . . 74.319999999999993 110.817 -172.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.659 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 2.1 mmm180 -94.01 -37.26 11.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.254 -0.43 . . . . 71.239999999999995 111.221 -177.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.718 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -100.19 10.77 40.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.479 -0.328 . . . . 71.310000000000002 110.464 -178.949 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.8 tttp -59.28 -59.72 5.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.589 . . . . 73.519999999999996 110.578 -176.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -63.35 -29.44 70.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.735 -0.666 . . . . 75.299999999999997 111.561 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.538 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 39.9 mtm -79.49 -27.77 41.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.226 0.536 . . . . 64.230000000000004 109.935 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.772 HD21 ' HD2' ' B' ' 269' ' ' TYR . 65.1 tp -70.11 -43.77 70.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.48 -0.782 . . . . 71.400000000000006 109.676 176.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.02 -34.09 71.49 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.278 -0.874 . . . . 72.010000000000005 110.506 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.17 -12.49 60.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.41 -0.814 . . . . 54.25 112.125 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.436 ' OD1' ' HG2' ' B' ' 242' ' ' ARG . 31.4 m-80 -100.92 -20.41 15.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.988 0.423 . . . . 63.149999999999999 111.322 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.417 ' C ' ' H ' ' A' ' 83' ' ' ASP . 63.0 mtt -78.84 -168.07 1.32 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.363 -0.38 . . . . 74.540000000000006 110.019 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 6.4 mm-40 68.46 -32.31 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 113.741 1.015 . . . . 74.400000000000006 113.741 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.417 ' H ' ' C ' ' A' ' 81' ' ' MET . 27.8 t70 -53.25 -58.3 7.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.88 0.326 . . . . 55.119999999999997 111.88 -177.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -88.53 -3.52 58.79 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.875 -0.73 . . . . 74.439999999999998 111.121 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.573 HG21 ' HB2' ' B' ' 259' ' ' GLN . 48.6 mt -74.78 -56.91 7.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.082 0.468 . . . . 72.319999999999993 109.84 173.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 10.0 pt-20 -60.86 -38.71 86.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 62.039999999999999 110.672 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -87.93 8.93 23.96 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.293 -0.412 . . . . 61.420000000000002 111.651 -177.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 92' ' ' ARG . 72.8 t80 -57.72 -42.32 83.58 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.158 -0.312 . . . . 70.230000000000004 110.158 178.513 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -57.96 -36.58 72.77 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.156 0.503 . . . . 72.409999999999997 110.019 177.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.544 ' O ' HG23 ' A' ' 94' ' ' THR . 6.3 t60 -69.26 -52.41 27.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.192 -0.913 . . . . 72.230000000000004 110.291 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -64.59 -39.97 94.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.898 0.38 . . . . 74.030000000000001 111.071 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.1 OUTLIER -66.87 -17.69 65.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.221 0.534 . . . . 71.120000000000005 110.264 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -94.36 -24.21 17.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.825 -0.625 . . . . 64.140000000000001 111.141 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 90' ' ' HIS . 81.9 p -72.36 -23.7 61.16 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.003 0.43 . . . . 51.450000000000003 110.872 -179.401 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -90.46 125.3 35.53 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.407 0.622 . . . . 72.530000000000001 110.044 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 115.329 -0.85 . . . . 44.439999999999998 111.259 -175.56 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.832 0.349 . . . . 73.030000000000001 110.482 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -81.01 173.64 12.41 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.734 -0.469 . . . . 62.0 109.734 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.67 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.1 p-10 -98.54 143.45 28.93 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.653 -0.499 . . . . 75.319999999999993 109.653 178.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -76.11 -83.43 0.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.11 -0.7 . . . . 74.230000000000004 109.11 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -119.57 -30.81 4.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.103 -0.702 . . . . 51.439999999999998 109.103 170.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.67 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -88.47 157.18 18.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.688 -0.687 . . . . 64.450000000000003 111.811 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.538 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -86.15 49.57 1.81 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.627 -1.17 . . . . 74.420000000000002 111.954 -175.571 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -45.13 -50.22 11.35 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.438 0.533 . . . . 72.340000000000003 112.438 -176.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 209' ' ' ALA . . . . . 0.517 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -59.88 -44.09 94.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 75.340000000000003 112.229 -174.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 32.3 mmt180 -67.28 -49.99 62.1 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.148 0.425 . . . . 64.200000000000003 112.148 -175.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.631 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -63.3 -18.71 63.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.691 0.758 . . . . 72.310000000000002 110.62 -177.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 212' ' ' THR . . . . . 0.517 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 49.3 m -68.64 -28.12 66.61 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.006 -0.997 . . . . 54.310000000000002 111.014 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.408 ' HB2' HD11 ' A' ' 17' ' ' LEU . 28.4 mt-10 -80.06 -29.32 39.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.462 0.649 . . . . 74.030000000000001 109.509 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.703 HD12 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -63.94 -45.43 89.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.214 -0.903 . . . . 75.430000000000007 109.922 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.447 HG13 ' HB1' ' A' ' 39' ' ' ALA . 77.3 mt -66.8 -24.82 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 54.409999999999997 110.302 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -30.57 70.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 74.349999999999994 110.661 -176.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.631 HD12 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -70.37 -40.75 73.81 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.783 -0.821 . . . . 70.109999999999999 108.783 175.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.58 -29.88 70.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.474 -0.784 . . . . 75.450000000000003 110.183 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.519 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 2.7 t-20 -59.9 -38.34 81.99 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.33 -0.85 . . . . 71.239999999999995 110.405 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -69.41 -39.71 77.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.763 -0.653 . . . . 63.210000000000001 111.282 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -74.0 -25.24 59.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.159 0.504 . . . . 75.540000000000006 110.163 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -84.07 -3.64 58.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.837 -0.62 . . . . 63.399999999999999 110.751 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 25.5 mt-30 -71.03 -10.73 60.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.436 0.636 . . . . 70.010000000000005 109.94 173.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -83.42 128.55 34.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.05 -0.977 . . . . 72.310000000000002 109.723 177.057 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -98.46 -21.82 16.36 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.079 0.466 . . . . 61.229999999999997 110.817 -175.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -76.9 -17.93 58.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.084 0.469 . . . . 70.209999999999994 110.724 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 7.3 mt -98.95 153.49 4.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.518 -0.919 . . . . 72.129999999999995 108.518 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.579 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 1.3 mp0 -80.57 146.38 31.28 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.454 -0.572 . . . . 73.030000000000001 109.454 176.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 27.6 m -58.25 -33.12 69.02 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.221 -0.659 . . . . 63.100000000000001 109.221 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.526 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -61.71 -29.71 72.84 Favored Glycine 0 C--N 1.334 0.44 0 CA-C-N 115.084 -0.962 . . . . 24.420000000000002 113.149 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.579 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 11.4 mm-40 -66.2 -36.43 83.05 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 117.356 0.578 . . . . 63.329999999999998 109.657 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.1 t -77.78 -27.75 15.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.371 -0.831 . . . . 65.219999999999999 110.108 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 233' ' ' SER . . . . . 0.462 ' HG ' ' HE2' ' A' ' 47' ' ' PHE . 1.8 m -70.83 -40.92 72.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.797 -0.638 . . . . 55.340000000000003 109.46 176.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -71.44 -34.34 70.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.264 -0.88 . . . . 71.109999999999999 111.223 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.477 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 30.1 p -67.89 -36.41 80.18 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.949 0.404 . . . . 63.130000000000003 110.016 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.58 ' CD1' HD12 ' A' ' 14' ' ' LEU . 6.6 t80 -62.45 -42.04 99.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.522 0.677 . . . . 73.430000000000007 109.421 174.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.718 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 8.6 ttm -66.09 -45.83 79.82 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.518 -0.764 . . . . 74.140000000000001 111.733 179.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.538 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 33.9 t-105 -63.7 -35.45 80.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 72.420000000000002 110.716 177.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -66.17 -35.48 80.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.499 -0.319 . . . . 75.340000000000003 110.789 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 52.4 tp -68.04 -35.87 78.97 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.285 -0.635 . . . . 75.239999999999995 109.285 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.441 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -66.15 -16.84 64.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.788 -0.642 . . . . 74.319999999999993 111.185 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 242' ' ' ARG . . . . . 0.436 ' HG2' ' OD1' ' A' ' 80' ' ' ASN . 36.8 mtm180 -95.47 -47.77 6.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.993 0.425 . . . . 64.319999999999993 110.411 176.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.497 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.6 t80 -70.99 -34.57 71.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.827 -0.624 . . . . 70.510000000000005 111.221 -173.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -81.33 -20.28 41.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.056 0.455 . . . . 62.340000000000003 111.229 -175.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -78.8 -7.46 57.87 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.469 . . . . 74.129999999999995 110.746 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -65.45 -27.64 68.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.487 -0.779 . . . . 73.450000000000003 110.908 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.712 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 74.2 m-85 -75.09 -0.52 19.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.08 -0.509 . . . . 72.120000000000005 112.037 -175.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -63.2 -27.59 70.83 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.096 -1.05 . . . . 72.219999999999999 110.694 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 75.7 p -70.16 -8.63 51.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.456 -0.372 . . . . 72.340000000000003 111.672 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 10.8 t -120.87 8.29 10.5 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.967 -0.293 . . . . 53.030000000000001 110.873 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 68.6 m -78.0 -44.3 27.03 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-O 120.63 0.252 . . . . 65.319999999999993 110.641 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.486 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 2.4 m-85 -149.07 177.57 9.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.867 0.365 . . . . 74.219999999999999 111.231 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.403 ' HG3' HG23 ' B' ' 254' ' ' THR . 8.9 pt-20 -91.5 -34.83 14.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.588 -0.733 . . . . 70.239999999999995 111.897 -172.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.403 HG23 ' HG3' ' B' ' 253' ' ' GLU . 75.4 p -117.98 161.4 19.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.411 -0.359 . . . . 70.439999999999998 110.508 -179.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.442 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.5 ptmt -66.55 -35.05 79.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.488 -0.324 . . . . 61.109999999999999 110.954 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.09 -50.03 73.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.061 0.458 . . . . 74.049999999999997 110.788 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.662 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 95.1 mt-30 -75.51 -23.62 56.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 75.140000000000001 110.392 -177.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.3 ttt -77.32 -47.52 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 74.049999999999997 110.665 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.573 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.6 tt0 -63.65 -35.07 79.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.693 -0.685 . . . . 63.130000000000003 111.689 -176.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.46 -13.31 62.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.844 0.354 . . . . 70.349999999999994 110.975 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.662 ' HD3' ' O ' ' B' ' 257' ' ' GLN . 3.2 mptp? -106.51 9.95 31.42 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.956 -0.566 . . . . 72.049999999999997 111.134 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.551 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.0 ptpt -50.37 -46.33 55.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 73.420000000000002 110.259 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.551 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.2 tp60 -80.54 -29.74 37.15 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.054 -0.521 . . . . 74.299999999999997 110.057 -177.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -67.26 -39.09 86.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 71.019999999999996 111.413 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -83.72 -24.29 31.27 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.563 -0.532 . . . . 70.049999999999997 109.563 -177.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 266' ' ' MET . . . . . . . . . . . . . 75.4 mtp -85.03 -22.37 29.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 73.430000000000007 111.599 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 267' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 17.0 t70 -62.21 -42.64 99.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.992 0.425 . . . . 72.409999999999997 111.025 -170.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.624 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 27.3 p90 -90.35 -14.42 33.12 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.907 -0.588 . . . . 72.019999999999996 110.647 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.772 ' HD2' HD21 ' A' ' 77' ' ' LEU . 1.3 m-30 -57.54 -47.12 82.89 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.606 0.241 . . . . 75.209999999999994 111.052 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.569 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -56.2 -48.13 77.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.195 0.521 . . . . 75.340000000000003 110.422 174.689 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -84.4 20.8 1.58 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.491 -0.777 . . . . 65.340000000000003 111.65 -171.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 14.6 mmm180 -90.38 -51.09 5.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 71.109999999999999 110.813 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.696 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -92.65 8.83 37.43 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.069 -0.514 . . . . 75.019999999999996 110.538 -177.185 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.485 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 87.8 tttt -59.59 -59.48 5.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.919 -0.582 . . . . 73.400000000000006 110.916 -177.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.33 -33.98 77.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.23 -0.441 . . . . 63.229999999999997 111.187 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 276' ' ' MET . . . . . 0.604 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 41.0 mtm -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.108 0.48 . . . . 74.400000000000006 110.441 -178.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 5.5 tt -70.96 -43.42 68.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.998 -0.742 . . . . 74.040000000000006 108.998 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -56.38 -37.13 69.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.961 -1.018 . . . . 70.340000000000003 111.12 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -68.47 -14.98 63.38 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.447 -0.797 . . . . 75.040000000000006 112.36 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -96.6 -13.33 22.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.878 0.371 . . . . 64.319999999999993 111.487 -178.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 62.9 mtt -85.56 179.58 7.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.777 0.323 . . . . 72.120000000000005 111.122 176.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.559 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 20.6 mt-10 69.89 -24.06 0.15 Allowed 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.416 1.086 . . . . 64.019999999999996 113.381 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -50.25 -60.18 3.23 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.896 0.379 . . . . 73.430000000000007 111.699 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -85.13 5.66 28.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 62.229999999999997 111.221 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.625 HG21 ' HB2' ' A' ' 59' ' ' GLN . 50.3 mt -92.82 -54.73 6.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.876 0.37 . . . . 74.319999999999993 110.507 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.8 pt-20 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.053 -0.521 . . . . 54.130000000000003 110.337 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.38 2.28 52.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 75.010000000000005 111.359 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.592 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 71.0 t80 -55.99 -48.19 76.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.634 0.254 . . . . 74.230000000000004 110.915 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -65.21 -31.33 72.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.712 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -65.55 -57.07 9.08 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.247 -0.649 . . . . 75.439999999999998 109.247 177.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 291' ' ' TYR . . . . . 0.518 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 21.3 m-85 -61.55 -46.88 88.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.653 -0.703 . . . . 70.439999999999998 111.325 -179.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -55.83 -32.84 63.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.98 0.419 . . . . 73.219999999999999 111.048 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -76.42 -28.65 56.73 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 116.065 -0.516 . . . . 72.049999999999997 111.694 -175.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 24.3 p -97.24 -16.45 20.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.39 -0.368 . . . . 73.400000000000006 111.734 -177.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 25.7 mt-30 -91.04 143.71 26.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.32 0.581 . . . . 74.540000000000006 111.648 -177.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt . . . . . 0 C--O 1.248 0.986 0 CA-C-N 115.076 -0.965 . . . . 73.129999999999995 109.4 -179.43 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 121.173 0.511 . . . . 70.340000000000003 111.173 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -104.41 -54.64 2.49 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.083 -0.71 . . . . 65.540000000000006 109.083 173.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -162.43 135.25 5.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.168 -0.924 . . . . 63.200000000000003 108.944 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.98 -79.69 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.123 0.487 . . . . 64.510000000000005 110.759 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -125.71 -35.85 2.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.947 -0.569 . . . . 62.240000000000002 110.393 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . . . -80.81 159.82 25.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.091 -0.504 . . . . 74.349999999999994 111.005 179.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.567 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -82.06 49.17 1.34 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.293 -0.867 . . . . 71.400000000000006 111.995 -176.413 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 6' ' ' ALA . 58.1 m-85 -51.93 -42.21 62.63 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.046 0.451 . . . . 74.209999999999994 111.235 -178.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.11 -13.64 61.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.742 -0.663 . . . . 74.209999999999994 112.509 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.437 HH11 ' HD3' ' A' ' 10' ' ' ARG . 20.5 mtm180 -94.71 -57.23 2.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.542 -0.463 . . . . 72.239999999999995 110.262 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.768 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -57.49 -22.47 44.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 55.009999999999998 112.54 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -62.75 -26.92 68.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.745 0.307 . . . . 71.439999999999998 110.955 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.487 ' HB2' HD11 ' B' ' 217' ' ' LEU . 30.0 mt-10 -83.12 -29.56 28.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.169 0.509 . . . . 73.019999999999996 109.772 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.768 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -62.82 -48.58 78.48 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.244 -0.889 . . . . 74.540000000000006 109.42 177.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.512 HG23 ' HD2' ' B' ' 243' ' ' TYR . 78.5 mt -64.07 -33.63 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.661 . . . . 73.140000000000001 110.281 176.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.414 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.6 tmmt? -60.11 -35.13 74.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.608 -0.724 . . . . 75.5 111.48 -176.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.463 HD12 HD13 ' B' ' 214' ' ' LEU . 2.6 tm? -63.54 -45.97 88.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.392 -0.596 . . . . 51.409999999999997 109.392 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.59 68.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.723 -0.671 . . . . 61.219999999999999 111.225 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.45 -26.33 68.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 62.109999999999999 111.214 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.434 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 1.4 mp0 -81.07 -14.97 57.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.838 0.351 . . . . 75.349999999999994 111.057 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -101.44 -35.28 9.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.95 0.405 . . . . 71.230000000000004 110.764 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.649 ' HA ' HG21 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -78.0 -8.95 58.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.208 -0.451 . . . . 73.310000000000002 110.721 -175.98 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.434 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 15.9 pt20 -80.87 9.0 7.0 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.839 -0.344 . . . . 74.209999999999994 111.531 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -82.84 103.46 12.34 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.231 -1.026 . . . . 74.510000000000005 108.231 173.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -60.16 -31.68 70.33 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 113.146 0.795 . . . . 74.010000000000005 113.146 -169.249 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -80.68 -13.43 59.03 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.227 0.455 . . . . 74.129999999999995 112.227 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 9.2 mt -98.66 147.8 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.448 -0.575 . . . . 50.009999999999998 109.448 179.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -89.42 159.75 17.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.824 0.345 . . . . 73.230000000000004 110.301 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.3 m -56.88 -33.33 66.77 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.529 -0.759 . . . . 75.510000000000005 111.315 -176.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -58.27 -32.4 67.75 Favored Glycine 0 C--N 1.332 0.34 0 CA-C-N 115.62 -0.718 . . . . 54.310000000000002 113.871 -176.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -69.27 -31.79 70.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.27 0.535 . . . . 74.310000000000002 110.932 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.649 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.3 t -88.63 -40.82 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.855 -0.611 . . . . 70.450000000000003 110.967 -176.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.8 p -61.59 -41.78 97.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.953 0.406 . . . . 72.329999999999998 110.635 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.3 73.88 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.014 -0.539 . . . . 74.329999999999998 110.958 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.479 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 46.2 m -63.51 -36.21 83.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.886 0.374 . . . . 61.409999999999997 110.068 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.556 ' CD1' HD12 ' B' ' 214' ' ' LEU . 2.5 t80 -69.5 -32.78 71.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.374 0.606 . . . . 73.439999999999998 109.66 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.786 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.2 tpt -67.36 -52.33 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.45 -0.795 . . . . 71.019999999999996 110.945 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.652 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -63.84 -34.89 78.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.937 -0.574 . . . . 75.450000000000003 110.906 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.41 -40.64 97.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.122 -0.49 . . . . 75.510000000000005 111.095 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 53.9 tp -68.37 -35.29 77.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.734 -0.469 . . . . 64.25 109.734 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.88 77.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.400000000000006 111.0 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.448 ' HG2' ' CG ' ' B' ' 280' ' ' ASN . 10.8 mtp180 -77.48 -46.46 22.42 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.019 -0.272 . . . . 74.239999999999995 111.139 177.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.588 ' HD2' HG23 ' B' ' 215' ' ' ILE . 7.5 t80 -66.57 -31.86 72.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 62.409999999999997 110.884 -175.159 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -77.33 -38.3 50.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.038 0.447 . . . . 52.509999999999998 109.95 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.88 -19.61 65.04 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.792 -0.64 . . . . 63.210000000000001 111.171 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.5 t90 -59.39 -33.54 71.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.845 -0.616 . . . . 72.129999999999995 110.029 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -82.66 -5.47 58.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 62.140000000000001 111.131 178.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.524 ' O ' ' HE3' ' A' ' 58' ' ' MET . . . -70.62 -23.87 77.36 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.896 -0.881 . . . . 73.349999999999994 110.896 174.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -61.46 -31.84 71.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.949 0.405 . . . . 52.210000000000001 111.26 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -97.91 13.42 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 71.530000000000001 111.103 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.1 m -77.02 -34.59 57.38 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 111.854 0.316 . . . . 71.340000000000003 111.854 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.725 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -143.33 -172.27 3.66 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.641 -0.424 . . . . 55.520000000000003 111.63 -179.551 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.725 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 16.9 pt-20 -108.31 -30.11 8.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.376 -0.829 . . . . 61.229999999999997 112.025 -170.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.451 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 47.1 p -127.87 155.28 44.4 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 109.715 -0.476 . . . . 65.319999999999993 109.715 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -72.03 -29.57 64.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.84 -0.344 . . . . 74.25 110.77 -177.157 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' OE1' ' HB ' ' A' ' 54' ' ' THR . 2.0 mp0 -60.92 -46.19 91.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.231 0.538 . . . . 74.140000000000001 110.186 177.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 24.6 mt-30 -81.58 -37.57 27.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.667 -0.697 . . . . 74.230000000000004 110.581 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.524 ' HE3' ' O ' ' A' ' 48' ' ' GLY . 16.5 ttt -63.17 -42.73 99.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 63.350000000000001 111.211 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 29.2 tt0 -64.69 -32.18 73.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.277 -0.419 . . . . 65.409999999999997 110.583 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.57 -12.34 60.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.149 0.5 . . . . 62.310000000000002 110.854 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -106.53 11.1 31.0 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.208 -0.451 . . . . 64.310000000000002 109.979 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.608 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 15.4 ptpt -54.27 -49.37 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 71.540000000000006 110.064 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.608 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 4.5 tp-100 -75.15 -26.97 59.55 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.98 -0.555 . . . . 71.430000000000007 110.239 -176.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 61' ' ' LYS . 25.0 mm-40 -58.85 -49.47 77.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.99 -0.55 . . . . 74.230000000000004 111.011 -178.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.464 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 3.4 ptt? -82.69 -34.86 27.2 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.067 0.46 . . . . 74.510000000000005 110.631 -177.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.531 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 67.1 mtp -77.08 -21.98 53.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 51.140000000000001 112.097 -174.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 25.6 t70 -58.95 -36.25 74.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 71.239999999999995 111.365 -171.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.492 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 28.2 p90 -107.15 -6.11 17.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 71.519999999999996 111.534 -176.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.531 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 3.4 m-30 -58.56 -41.95 86.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.709 0.29 . . . . 73.109999999999999 110.943 -178.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.517 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -53.28 -52.35 59.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 64.519999999999996 110.665 174.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -90.48 65.98 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 71.129999999999995 110.958 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 15.3 mmm-85 -130.98 -23.24 2.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.195 -0.457 . . . . 71.140000000000001 111.337 177.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.765 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -116.05 7.74 14.35 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.543 -0.463 . . . . 74.519999999999996 111.755 -178.782 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.3 pttm -76.2 -33.92 59.29 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.856 -0.738 . . . . 74.120000000000005 110.323 -173.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 1.6 pm0 -67.69 -25.17 65.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.278 0.561 . . . . 74.109999999999999 110.604 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.505 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 58.5 mtm -91.16 -18.95 23.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.818 -0.628 . . . . 71.219999999999999 109.971 178.116 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.487 HD13 ' CE ' ' B' ' 270' ' ' MET . 7.0 tt -82.39 -37.39 25.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.73 -0.668 . . . . 55.119999999999997 109.729 176.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.402 ' N ' ' HE1' ' B' ' 266' ' ' MET . 12.8 t70 -57.81 -37.56 73.99 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.256 0.551 . . . . 70.040000000000006 110.142 177.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.1 70.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.265 -0.879 . . . . 64.109999999999999 111.679 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -82.83 -23.09 33.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.016 0.436 . . . . 74.5 110.286 -178.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.484 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.3 mmt -66.54 -50.28 63.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.81 -0.632 . . . . 60.130000000000003 110.123 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 44.7 mt-10 -55.77 -31.82 62.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.681 -0.69 . . . . 73.299999999999997 111.637 -177.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -53.7 -34.74 59.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.855 0.36 . . . . 74.439999999999998 111.04 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.72 -29.14 10.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.286 -0.415 . . . . 74.510000000000005 111.255 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 81' ' ' MET . 58.5 mt -66.77 -64.53 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.653 0.242 . . . . 63.329999999999998 111.653 -178.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.3 pt-20 -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.451 -0.5 . . . . 75.0 110.745 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 24.4 m120 -93.04 15.72 14.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.139 -0.482 . . . . 71.340000000000003 111.004 -177.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.577 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 24.7 t80 -54.46 -49.78 69.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.707 0.289 . . . . 74.010000000000005 110.985 178.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -61.91 -23.24 66.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 75.310000000000002 111.004 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -78.97 -50.9 10.38 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.804 -0.443 . . . . 72.530000000000001 109.804 177.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.523 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 73.3 m-85 -62.98 -42.63 99.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 74.120000000000005 111.018 178.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -69.77 -4.31 19.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.297 0.57 . . . . 72.340000000000003 110.817 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -97.3 -29.57 13.47 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.142 -0.481 . . . . 65.409999999999997 110.43 177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 p -89.95 -35.23 15.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.04 -0.527 . . . . 50.32 110.331 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -117.26 141.64 48.04 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.287 -0.635 . . . . 75.400000000000006 109.287 176.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 96' ' ' LYS . 44.4 mtmt . . . . . 0 C--N 1.321 -0.666 0 CA-C-N 116.183 -0.462 . . . . 62.439999999999998 110.611 -176.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 71.0 m . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.123 0.487 . . . . 62.149999999999999 111.105 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -131.27 -172.59 2.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.738 -0.664 . . . . 65.25 109.692 177.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 -101.18 156.39 17.46 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.665 0.269 . . . . 72.349999999999994 110.562 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 204' ' ' GLU . . . . . 0.444 ' H ' ' HE2' ' B' ' 208' ' ' TYR . 26.0 mt-10 -82.76 -94.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 54.109999999999999 111.164 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 205' ' ' ASN . . . . . 0.402 ' H ' ' HB2' ' B' ' 204' ' ' GLU . 12.7 t30 -103.32 -26.66 12.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.879 -0.6 . . . . 61.409999999999997 110.055 -177.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -110.0 153.29 24.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.581 -0.736 . . . . 64.439999999999998 110.475 176.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.652 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -79.05 54.89 1.69 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.422 -0.808 . . . . 71.510000000000005 112.464 -177.757 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.444 ' HE2' ' H ' ' B' ' 204' ' ' GLU . 17.6 m-85 -50.95 -40.8 58.4 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.92 0.39 . . . . 75.219999999999999 111.379 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.34 -27.53 66.0 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.479 -0.782 . . . . 71.519999999999996 112.696 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 53.6 mtm-85 -91.88 -55.38 3.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.548 -0.461 . . . . 72.010000000000005 110.651 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.632 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.4 -22.64 44.31 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 34.130000000000003 112.814 -177.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 7.0 t -67.04 -25.81 66.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.95 0.405 . . . . 54.439999999999998 110.51 -177.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -82.45 -29.22 30.79 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.345 0.593 . . . . 71.329999999999998 109.787 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.632 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -64.51 -45.35 87.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.076 -0.965 . . . . 72.5 109.392 177.239 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.588 HG23 ' HD2' ' A' ' 43' ' ' TYR . 82.0 mt -67.35 -33.03 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.564 -0.744 . . . . 71.109999999999999 110.452 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -35.59 73.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.683 -0.69 . . . . 63.43 111.286 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.535 HD12 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -64.57 -45.37 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.414 -0.587 . . . . 75.329999999999998 109.414 178.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.88 -31.84 68.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 74.349999999999994 111.164 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.504 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 5.5 m-20 -61.08 -38.08 84.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 71.120000000000005 110.919 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -67.68 -34.48 76.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.197 -0.456 . . . . 70.299999999999997 111.466 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -79.33 -23.07 43.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.445 0.64 . . . . 73.510000000000005 110.049 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 58.4 t30 -75.64 -16.25 60.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.266 -0.879 . . . . 74.209999999999994 110.267 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.504 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 35.7 mt-30 -76.63 -4.11 41.29 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 73.219999999999999 111.201 -179.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.419 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.1 t-20 -73.01 107.66 5.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.545 -0.539 . . . . 34.530000000000001 109.545 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.0 t -57.71 -35.71 71.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.017 0.747 . . . . 75.209999999999994 113.017 -171.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -85.32 1.55 47.93 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.508 0.559 . . . . 73.319999999999993 112.508 -177.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.419 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.1 mt -113.76 149.85 16.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.03 0.443 . . . . 61.310000000000002 110.326 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -92.53 160.22 15.14 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.853 -0.612 . . . . 65.219999999999999 109.875 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 6.8 m -63.02 -29.63 70.97 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.19 -0.459 . . . . 75.530000000000001 111.227 -176.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -67.38 -12.22 60.71 Favored Glycine 0 C--N 1.331 0.297 0 CA-C-N 115.901 -0.59 . . . . 73.420000000000002 113.339 -177.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.401 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 67.9 mm-40 -83.47 -25.79 30.84 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.342 -0.505 . . . . 74.409999999999997 110.524 178.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.9 t -85.35 -39.16 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.963 -0.562 . . . . 43.310000000000002 110.43 -177.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.2 p -59.06 -41.64 88.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 74.299999999999997 110.957 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.83 -32.1 71.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 74.439999999999998 111.016 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 49.9 m -65.43 -38.02 88.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.82 0.343 . . . . 43.439999999999998 110.279 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.672 ' HD1' HD12 ' A' ' 14' ' ' LEU . 11.9 t80 -66.36 -33.66 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.259 0.552 . . . . 64.219999999999999 109.831 178.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.765 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 9.3 ttm -69.18 -46.0 68.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.507 -0.769 . . . . 72.349999999999994 111.735 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.567 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 19.8 t-105 -64.59 -38.51 91.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.85 0.357 . . . . 74.010000000000005 110.645 177.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.5 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -61.82 -40.29 94.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.051 -0.522 . . . . 44.340000000000003 110.667 178.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.786 HD21 ' SD ' ' A' ' 37' ' ' MET . 45.3 tp -67.84 -32.6 73.24 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.257 -0.429 . . . . 71.439999999999998 110.831 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.42 -37.35 85.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.010000000000005 110.893 178.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -80.77 -30.69 36.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 72.319999999999993 110.888 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.512 ' HD2' HG23 ' A' ' 15' ' ' ILE . 6.6 t80 -82.07 -33.07 30.03 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.082 -0.508 . . . . 64.25 110.999 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 244' ' ' ASN . . . . . 0.454 ' HB3' HD11 ' A' ' 77' ' ' LEU . 9.9 t-20 -78.28 -38.71 41.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.416 -0.356 . . . . 72.420000000000002 111.177 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -63.8 -13.38 43.79 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.073 0.463 . . . . 42.25 111.482 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -54.02 -36.37 62.93 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.511 -0.768 . . . . 70.5 110.258 175.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -78.36 -5.55 52.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 74.099999999999994 111.958 -177.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -65.67 -29.82 75.97 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.402 -0.904 . . . . 64.409999999999997 111.578 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.5 p -65.07 -34.95 79.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.995 0.426 . . . . 61.340000000000003 111.298 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.2 t -92.35 7.74 41.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.419 -0.355 . . . . 71.310000000000002 111.298 -176.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 71.2 m -74.41 -40.16 62.18 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 116.737 -0.211 . . . . 63.009999999999998 111.386 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.55 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -151.41 -179.31 7.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.19 0.519 . . . . 74.010000000000005 111.731 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 7.9 pt-20 -94.42 -45.43 7.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.216 -0.902 . . . . 74.239999999999995 111.704 -173.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 41.2 p -106.1 157.87 17.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.369 -0.378 . . . . 70.129999999999995 110.227 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.577 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 11.2 ptmm? -66.84 -33.28 75.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.88 0.372 . . . . 73.340000000000003 110.237 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.11 -50.39 73.42 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.61 -0.723 . . . . 74.230000000000004 110.738 -179.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 97.8 mt-30 -78.66 -31.88 46.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.981 -0.554 . . . . 60.020000000000003 110.845 -177.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.7 ttt -64.96 -43.77 91.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.133 0.492 . . . . 74.329999999999998 110.194 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -63.09 -35.32 79.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.532 -0.758 . . . . 74.310000000000002 110.859 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.3 -11.5 60.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.222 -0.445 . . . . 60.149999999999999 111.197 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.59 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -113.44 -1.19 14.24 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.499 -0.319 . . . . 73.109999999999999 110.51 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.565 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 29.1 ttpp -55.4 -54.79 39.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.486 -0.324 . . . . 64.219999999999999 111.206 -176.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -68.41 -26.72 65.68 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.973 -0.291 . . . . 71.140000000000001 110.74 -178.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -73.54 -37.88 65.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.524 -0.307 . . . . 72.420000000000002 111.285 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.565 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 17.9 ptp -79.85 -30.21 40.26 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.297 -1.001 . . . . 72.140000000000001 108.297 177.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.402 ' HE1' ' N ' ' A' ' 78' ' ' ASP . 58.5 mtp -90.5 29.77 1.24 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.981 -1.008 . . . . 74.120000000000005 110.638 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -111.03 -32.91 6.64 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.958 -1.126 . . . . 75.140000000000001 107.958 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -87.16 -33.72 19.3 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.576 -1.193 . . . . 72.510000000000005 112.617 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -52.53 -52.52 54.39 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.987 -0.745 . . . . 74.450000000000003 108.987 177.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.517 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -65.45 -60.72 2.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.225 0.536 . . . . 70.409999999999997 110.829 174.263 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -88.82 62.96 6.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.811 -0.631 . . . . 72.329999999999998 112.04 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -147.76 -29.07 0.33 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 71.310000000000002 111.695 171.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.591 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -84.41 0.9 47.71 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.801 -0.814 . . . . 72.299999999999997 108.801 174.886 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -64.32 -53.87 42.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.414 -1.266 . . . . 74.25 110.676 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.25 -30.84 69.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.43 . . . . 73.129999999999995 111.818 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 276' ' ' MET . . . . . 0.493 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 60.1 mtm -84.87 -26.66 27.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.84 0.352 . . . . 54.399999999999999 110.602 -179.417 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 273' ' ' TYR . 3.7 tt -67.02 -33.92 76.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.016 -0.538 . . . . 73.430000000000007 109.784 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 278' ' ' ASP . . . . . 0.415 ' N ' ' HE1' ' A' ' 66' ' ' MET . 10.6 t70 -61.29 -44.18 97.65 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.837 -0.62 . . . . 64.230000000000004 110.831 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.34 65.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.391 -0.822 . . . . 65.230000000000004 111.159 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 280' ' ' ASN . . . . . 0.448 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 16.5 m120 -88.65 -15.91 33.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.046 -0.525 . . . . 73.439999999999998 110.344 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.404 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -75.5 -39.47 58.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 64.420000000000002 109.844 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 42.7 mt-10 -51.22 -39.59 56.9 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.374 -0.83 . . . . 73.400000000000006 111.934 -176.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -44.7 -47.81 10.66 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.939 0.774 . . . . 74.319999999999993 111.855 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -90.41 -29.86 17.75 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.249 -0.432 . . . . 73.239999999999995 111.017 -177.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.404 HG13 ' O ' ' B' ' 281' ' ' MET . 72.4 mt -64.37 -55.53 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 73.340000000000003 110.992 179.513 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.656 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -68.75 -17.63 64.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.283 -0.417 . . . . 54.439999999999998 111.664 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -107.95 9.46 28.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.921 0.341 . . . . 73.019999999999996 111.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -55.68 -45.73 77.73 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.792 0.329 . . . . 73.540000000000006 110.572 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -57.46 -33.52 68.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.848 -0.615 . . . . 71.409999999999997 110.978 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -77.43 -50.33 12.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.242 -0.435 . . . . 72.049999999999997 110.643 -177.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 291' ' ' TYR . . . . . 0.556 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 58.3 m-85 -60.57 -52.03 66.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.358 -0.383 . . . . 74.140000000000001 111.359 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.571 ' NH1' ' HA ' ' B' ' 296' ' ' LYS . 13.2 tpp180 -66.83 -13.42 61.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.093 0.473 . . . . 73.019999999999996 111.07 -177.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -83.86 -31.97 25.47 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.227 0.537 . . . . 51.229999999999997 110.532 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 4.1 p -95.47 -39.3 10.05 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.549 -0.751 . . . . 73.329999999999998 111.298 -176.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 5.1 pp0? -123.72 161.56 24.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.536 0.684 . . . . 64.120000000000005 112.056 -176.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 296' ' ' LYS . . . . . 0.571 ' HA ' ' NH1' ' B' ' 292' ' ' ARG . 44.0 mtmt . . . . . 0 C--O 1.246 0.918 0 CA-C-N 114.919 -1.037 . . . . 62.130000000000003 109.542 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.844 0.354 . . . . 71.109999999999999 110.826 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -71.89 148.58 45.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.33 -0.395 . . . . 73.200000000000003 111.067 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.599 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 1.7 p-10 -146.34 132.43 19.31 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.003 -0.544 . . . . 71.299999999999997 109.665 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.91 -89.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 63.539999999999999 110.642 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -111.3 -22.34 11.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.833 -0.621 . . . . 72.439999999999998 110.183 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.69 160.96 17.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 75.329999999999998 111.192 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.456 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -85.41 49.98 1.86 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.236 -0.893 . . . . 63.43 111.769 -177.668 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.599 ' HD2' ' HB2' ' A' ' 3' ' ' ASN . 89.5 m-85 -52.19 -46.3 65.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.037 0.446 . . . . 74.349999999999994 111.321 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.53 -6.53 47.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 54.020000000000003 112.02 -174.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.558 ' HA ' ' NE ' ' A' ' 10' ' ' ARG . 4.1 mmp_? -96.37 -58.45 2.06 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 121.089 -0.244 . . . . 61.219999999999999 110.561 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.724 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -56.42 -20.35 19.29 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.626 0.602 . . . . 63.020000000000003 112.626 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.3 t -69.35 -23.34 63.75 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 121.03 -0.268 . . . . 71.439999999999998 111.334 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.559 ' HB2' HD11 ' B' ' 217' ' ' LEU . 59.9 mt-10 -80.66 -28.63 36.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.271 -0.641 . . . . 71.030000000000001 109.271 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.724 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -64.41 -43.19 95.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.246 -0.888 . . . . 72.209999999999994 109.6 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 78.2 mt -69.46 -25.17 28.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.547 -0.751 . . . . 61.329999999999998 110.55 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.468 ' HD2' ' HA ' ' A' ' 16' ' ' LYS . 22.2 mmmt -61.75 -38.51 88.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.374 -0.375 . . . . 74.430000000000007 111.872 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.499 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.1 tm? -65.4 -34.23 77.81 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.235 -0.654 . . . . 75.519999999999996 109.235 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.98 -35.94 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.584 -0.735 . . . . 74.329999999999998 110.393 -177.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -69.92 -12.3 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.969 -0.56 . . . . 62.25 111.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.29 -39.65 17.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.792 0.329 . . . . 74.25 110.692 175.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -76.35 -22.48 54.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.293 0.568 . . . . 64.109999999999999 110.259 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -73.23 -11.82 60.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 74.230000000000004 110.553 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -82.22 0.83 39.39 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 116.096 -0.502 . . . . 73.420000000000002 111.674 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -73.77 115.46 13.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.22 -0.659 . . . . 65.219999999999999 109.22 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -50.18 -41.6 49.65 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.794 1.035 . . . . 63.340000000000003 113.794 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -97.5 2.44 50.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.111 0.782 . . . . 73.340000000000003 113.111 -171.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.7 mt -104.66 157.54 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.568 -0.53 . . . . 73.450000000000003 109.568 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -96.45 167.61 11.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.555 -0.535 . . . . 74.209999999999994 109.555 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.7 m -60.52 -32.12 71.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.016 0.436 . . . . 62.439999999999998 109.871 174.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.697 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -59.46 -38.21 93.19 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.258 -0.883 . . . . 63.409999999999997 113.714 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -64.91 -36.79 85.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.163 0.506 . . . . 72.129999999999995 110.439 -176.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 17.8 t -73.74 -39.14 52.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.866 -0.607 . . . . 70.030000000000001 110.199 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m -59.56 -41.85 91.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.236 0.541 . . . . 71.019999999999996 110.248 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 37' ' ' MET . . . -69.4 -29.92 67.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.641 -0.709 . . . . 71.530000000000001 110.938 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.2 m -65.18 -38.08 89.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.021 0.439 . . . . 72.209999999999994 109.911 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.842 ' HB3' HD13 ' B' ' 240' ' ' LEU . 1.6 t80 -67.99 -34.37 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.849 -0.614 . . . . 72.200000000000003 109.753 177.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.756 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 0.8 OUTLIER -61.71 -53.49 55.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.364 -0.834 . . . . 72.400000000000006 110.762 177.156 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.46 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 24.2 t-105 -64.89 -40.24 94.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 74.230000000000004 111.012 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.38 93.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.343 -0.39 . . . . 72.450000000000003 111.241 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 48.3 tp -61.98 -38.18 87.6 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.593 -0.276 . . . . 52.140000000000001 110.285 178.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -61.82 -46.07 91.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 43.210000000000001 110.711 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -66.86 -39.75 87.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.191 -0.459 . . . . 64.510000000000005 111.059 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.711 ' HD2' HG23 ' B' ' 215' ' ' ILE . 11.0 t80 -76.94 -33.93 57.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.372 -0.377 . . . . 74.230000000000004 110.853 -176.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 9.8 t-20 -73.02 -43.3 62.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.217 -0.447 . . . . 75.140000000000001 110.759 -176.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.442 ' HB2' HD12 ' B' ' 277' ' ' LEU . . . -67.67 -18.61 65.0 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.175 -0.466 . . . . 71.530000000000001 111.335 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -59.01 -30.62 68.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.978 -0.555 . . . . 75.129999999999995 110.496 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -83.91 -10.11 58.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 73.109999999999999 111.282 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.77 -24.02 72.64 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.466 -0.873 . . . . 75.099999999999994 111.383 176.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.646 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 79.3 p -69.92 -15.15 63.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 63.109999999999999 111.355 -178.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.9 t -114.47 13.26 17.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 61.350000000000001 110.855 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -72.04 -35.09 69.25 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 116.505 -0.316 . . . . 53.310000000000002 111.501 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.651 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.2 m-85 -147.92 178.74 8.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.409 0.623 . . . . 53.219999999999999 112.387 -178.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.593 ' HG3' HG23 ' A' ' 54' ' ' THR . 15.1 pt-20 -91.7 -34.58 14.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.766 -1.107 . . . . 72.349999999999994 110.798 -171.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.614 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 80.5 p -124.71 159.3 31.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.498 -0.774 . . . . 74.409999999999997 109.219 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.657 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 6.6 pttm -78.67 -23.6 45.61 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.424 -0.51 . . . . 71.519999999999996 110.557 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.614 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.6 mp0 -61.34 -40.73 95.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.256 0.55 . . . . 63.32 109.808 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.768 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 95.0 mt-30 -83.52 -40.83 18.67 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.514 -0.766 . . . . 64.530000000000001 109.684 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.657 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 17.1 ttt -57.21 -44.55 83.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.755 -0.657 . . . . 72.409999999999997 111.605 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.611 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.3 tt0 -59.95 -39.34 85.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.343 -0.389 . . . . 72.129999999999995 111.052 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.68 -0.09 19.51 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.998 -0.547 . . . . 73.140000000000001 111.24 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.768 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.7 mmmt -112.47 -6.62 13.97 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.55 -0.295 . . . . 72.219999999999999 111.24 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 34.2 pttt -63.87 -43.34 96.38 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 119.996 -0.682 . . . . 72.019999999999996 110.146 -176.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.579 ' O ' ' HB2' ' A' ' 67' ' ' ASP . 21.5 mm-40 -83.16 3.19 31.89 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.033 0.444 . . . . 73.239999999999995 111.168 177.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -97.47 -32.83 11.63 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.651 -0.704 . . . . 73.310000000000002 110.426 171.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.407 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 16.7 ptp -85.15 -35.26 21.84 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.682 -0.859 . . . . 52.43 108.682 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.575 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 69.0 mtp -80.64 -18.83 46.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.727 -0.669 . . . . 74.349999999999994 111.091 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 22.7 t70 -47.74 -45.75 29.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.672 0.608 . . . . 75.340000000000003 111.038 -178.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -108.15 -4.92 17.23 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.399 -0.819 . . . . 73.400000000000006 111.115 -176.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.628 ' HD2' HD21 ' B' ' 277' ' ' LEU . 1.8 m-30 -59.22 -48.26 82.28 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 121.305 -0.158 . . . . 73.409999999999997 111.05 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.567 ' HE1' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.08 -51.58 63.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.166 0.507 . . . . 54.43 110.206 175.892 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.466 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 1.9 t70 -90.7 22.74 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.65 -0.704 . . . . 74.239999999999995 111.291 -171.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.587 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 3.2 mmm180 -84.71 -44.93 12.92 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.209 0.528 . . . . 70.239999999999995 110.251 -176.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.737 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -95.44 15.09 20.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.663 -0.699 . . . . 70.340000000000003 109.929 -179.107 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HD2' ' OD2' ' A' ' 71' ' ' ASP . 20.0 tttp -56.15 -61.87 2.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.377 -0.829 . . . . 73.109999999999999 110.345 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -67.38 -31.12 71.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.669 -0.696 . . . . 72.099999999999994 110.977 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.8 mtt -62.04 -38.86 90.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.349 0.595 . . . . 74.140000000000001 109.816 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.591 ' CD2' ' HE2' ' A' ' 81' ' ' MET . 1.6 tt -73.55 -42.28 61.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.298 -0.865 . . . . 73.230000000000004 109.499 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.456 ' N ' ' HE1' ' B' ' 266' ' ' MET . 4.9 t70 -57.67 -42.04 82.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.447 -0.797 . . . . 72.319999999999993 110.831 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.59 -16.05 59.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.416 -0.811 . . . . 61.039999999999999 112.233 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -105.06 -16.07 14.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.844 0.354 . . . . 72.120000000000005 110.492 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.591 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 14.0 mmt -67.6 -63.02 1.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.906 -0.588 . . . . 64.319999999999993 111.55 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.632 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 8.3 pt-20 -80.6 1.85 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.835 0.68 . . . . 72.409999999999997 112.835 -170.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.39 -49.67 76.91 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.152 -0.684 . . . . 61.420000000000002 109.152 171.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -72.86 -38.26 67.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.482 -0.781 . . . . 70.239999999999995 110.189 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.735 HG21 ' HB2' ' B' ' 259' ' ' GLN . 66.7 mt -58.97 -54.25 36.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.523 -0.762 . . . . 73.140000000000001 111.941 -176.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.626 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.1 pt-20 -66.48 -12.15 55.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.652 0.263 . . . . 72.519999999999996 111.673 -177.034 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -110.57 11.4 22.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.668 -0.242 . . . . 74.310000000000002 111.4 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.474 ' CE2' ' HA ' ' B' ' 254' ' ' THR . 8.5 t80 -52.71 -56.37 16.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.282 . . . . 74.340000000000003 110.294 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.29 -30.3 71.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.913 -0.585 . . . . 74.040000000000006 110.911 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -63.03 -58.93 5.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.101 -0.499 . . . . 73.219999999999999 110.133 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -65.63 -45.62 82.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.426 -0.352 . . . . 64.409999999999997 110.91 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.471 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 2.4 tmm_? -60.6 -23.96 65.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.551 . . . . 61.140000000000001 110.44 -177.196 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.59 -39.78 62.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.149 -0.478 . . . . 61.43 110.654 -179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 35.7 p -79.61 -23.4 42.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.816 -0.629 . . . . 73.040000000000006 111.277 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -81.95 111.74 18.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.355 0.597 . . . . 71.049999999999997 110.951 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt . . . . . 0 C--N 1.317 -0.845 0 CA-C-N 115.306 -0.861 . . . . 72.430000000000007 110.365 -176.933 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 0 C--O 1.234 0.256 0 CA-C-O 121.125 0.488 . . . . 74.109999999999999 110.46 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -142.06 164.23 30.72 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.029 -0.73 . . . . 52.350000000000001 109.029 178.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.8 p-10 -142.95 139.31 30.63 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 121.004 -0.278 . . . . 72.340000000000003 110.598 -178.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -68.92 -77.69 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.016 0.436 . . . . 75.5 110.162 175.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -128.51 -31.15 2.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 74.230000000000004 110.323 176.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -86.68 179.35 6.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.733 -0.667 . . . . 54.299999999999997 111.339 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.54 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -79.68 43.93 0.6 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.433 -0.803 . . . . 75.420000000000002 112.674 -174.264 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.75 -43.39 85.37 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.667 0.247 . . . . 72.310000000000002 111.667 -177.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.96 -14.88 62.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.033 0.444 . . . . 53.119999999999997 111.447 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.54 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 1.4 mmp_? -91.0 -62.16 1.51 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.343 -0.39 . . . . 74.230000000000004 110.17 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.836 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.37 -25.77 37.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.699 0.629 . . . . 33.049999999999997 112.699 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 212' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -67.97 -21.16 65.09 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.764 0.316 . . . . 73.5 110.946 -178.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.409 ' HB2' HD11 ' A' ' 17' ' ' LEU . 50.7 mt-10 -84.64 -27.58 27.06 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.619 -0.511 . . . . 74.319999999999993 109.619 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.836 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -62.44 -41.32 98.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.514 -0.767 . . . . 73.510000000000005 109.43 176.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.711 HG23 ' HD2' ' A' ' 43' ' ' TYR . 87.5 mt -68.8 -22.83 26.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.204 -0.907 . . . . 73.209999999999994 111.027 178.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' B' ' 212' ' ' THR . 30.6 mmmt -66.58 -40.42 88.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 73.340000000000003 111.603 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.559 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -62.47 -35.98 81.04 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.058 -0.719 . . . . 65.239999999999995 109.058 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 218' ' ' ALA . . . . . 0.425 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -67.84 -37.42 81.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.731 -0.668 . . . . 54.240000000000002 110.145 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.412 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 29.2 m-80 -74.37 -6.49 48.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.99 -0.55 . . . . 72.099999999999994 111.509 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -93.98 -32.81 13.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.368 . . . . 73.430000000000007 110.789 175.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -75.78 -27.09 57.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.508 0.671 . . . . 74.120000000000005 109.689 175.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -71.72 -12.76 61.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.985 -1.007 . . . . 74.409999999999997 110.481 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 86.9 mm-40 -75.22 -15.04 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.102 -0.499 . . . . 73.430000000000007 111.578 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.644 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.1 t-20 -71.56 122.45 20.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.189 0.519 . . . . 54.25 109.719 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -65.66 -30.28 70.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.241 -0.89 . . . . 63.340000000000003 112.162 -174.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.14 -1.33 45.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.443 0.534 . . . . 71.329999999999998 112.443 -172.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.644 HG13 ' HB3' ' B' ' 224' ' ' ASN . 8.9 mt -99.2 148.63 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.358 -0.608 . . . . 53.399999999999999 109.358 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.813 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 42.7 mt-30 -78.21 147.38 34.47 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.859 -0.609 . . . . 75.230000000000004 109.865 178.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 3.8 m -59.82 -34.63 73.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.041 0.448 . . . . 72.519999999999996 110.662 -178.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.28 87.68 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.861 -0.609 . . . . 75.25 113.816 -176.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.813 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 16.8 mm-40 -80.49 -29.52 37.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.842 0.821 . . . . 54.109999999999999 109.674 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 232' ' ' VAL . . . . . 0.425 HG11 ' O ' ' B' ' 218' ' ' ALA . 27.7 t -77.35 -41.34 29.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.27 -0.877 . . . . 71.109999999999999 110.938 -176.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.8 p -62.27 -40.16 95.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 72.109999999999999 110.816 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.45 75.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.899 -0.591 . . . . 74.150000000000006 110.934 179.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 64.0 m -65.06 -34.24 77.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 63.219999999999999 110.715 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.538 ' CD1' HD12 ' A' ' 14' ' ' LEU . 5.3 t80 -65.83 -36.65 84.07 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.309 0.576 . . . . 55.530000000000001 109.808 178.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.737 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.6 ttm -69.52 -48.39 60.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.751 -0.658 . . . . 64.030000000000001 111.547 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.456 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 34.9 t-105 -63.33 -35.04 79.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.327 . . . . 72.519999999999996 110.782 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.487 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.95 -40.49 95.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 75.120000000000005 110.894 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.842 HD13 ' HB3' ' A' ' 36' ' ' PHE . 43.8 tp -69.1 -32.13 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.979 0.418 . . . . 74.340000000000003 110.399 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.447 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -63.06 -41.4 99.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.901 -0.591 . . . . 63.140000000000001 110.829 178.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -75.3 -26.65 58.88 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.15 0.5 . . . . 74.219999999999999 110.275 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -81.4 -36.52 29.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.716 -0.674 . . . . 55.020000000000003 110.854 -176.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -74.76 -27.82 60.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.659 0.266 . . . . 72.319999999999993 111.376 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.54 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -71.98 -16.0 62.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.243 0.544 . . . . 61.5 111.105 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -55.88 -33.68 64.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 73.310000000000002 110.256 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.697 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 56.3 m-85 -71.63 -13.59 61.8 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.019 -0.537 . . . . 53.340000000000003 112.173 -177.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.0 87.82 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.254 -0.974 . . . . 74.239999999999995 111.489 177.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.461 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 6.1 m -59.96 -30.96 69.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.814 0.34 . . . . 75.099999999999994 111.732 -177.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.0 t -102.26 16.86 24.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.056 0.455 . . . . 44.409999999999997 111.038 -176.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 22.9 t -78.01 -66.05 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.323 -0.399 . . . . 72.030000000000001 110.89 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.626 ' CD1' ' HG3' ' B' ' 261' ' ' LYS . 2.4 m-85 -135.15 -169.99 2.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.293 0.568 . . . . 71.310000000000002 112.511 -174.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.733 ' HG3' ' H ' ' B' ' 254' ' ' THR . 5.4 pt-20 -95.82 -61.16 1.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.854 -1.066 . . . . 71.150000000000006 110.154 -177.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.733 ' H ' ' HG3' ' B' ' 253' ' ' GLU . 74.8 p -89.81 154.41 19.92 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.89 -0.596 . . . . 74.109999999999999 110.461 -177.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 10.4 ptmm? -71.5 -26.82 62.84 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.753 -0.379 . . . . 72.510000000000005 110.534 -177.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.8 -51.18 70.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.045 -0.525 . . . . 71.340000000000003 110.402 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.652 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 95.1 mt-30 -77.47 -40.72 42.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 63.420000000000002 110.063 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.461 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 21.5 ttt -57.79 -40.66 80.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.433 -0.803 . . . . 52.32 111.179 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.735 ' HB2' HG21 ' A' ' 85' ' ' ILE . 30.1 tt0 -71.34 -29.44 64.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.443 . . . . 74.209999999999994 111.44 -178.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.25 -15.54 59.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.011 0.434 . . . . 73.150000000000006 110.872 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.9 mmmt -95.66 -7.59 37.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.281 -0.418 . . . . 71.340000000000003 111.414 -174.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.566 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 56.6 pttt -58.14 -47.08 84.43 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.432 -0.349 . . . . 71.319999999999993 110.763 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.553 ' O ' ' HB2' ' B' ' 267' ' ' ASP . 8.3 mm100 -74.67 -16.05 60.78 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.461 -0.496 . . . . 70.409999999999997 111.623 -178.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -80.39 -32.59 37.53 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.779 -0.369 . . . . 74.5 110.407 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.566 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 15.3 ptp -89.73 -26.44 20.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.379 -0.6 . . . . 54.409999999999997 109.379 178.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.489 ' HG2' HD22 ' A' ' 77' ' ' LEU . 83.8 mtp -85.02 -20.68 30.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.788 -0.642 . . . . 25.350000000000001 111.615 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 267' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 9.0 t70 -52.35 -47.64 65.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.485 0.66 . . . . 75.200000000000003 110.404 -175.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.45 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 8.8 p90 -96.83 0.12 48.78 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.316 -0.856 . . . . 72.510000000000005 110.858 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.465 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.2 m-30 -68.39 -50.52 52.4 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.702 -0.851 . . . . 74.049999999999997 108.702 171.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.502 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -53.36 -55.94 20.81 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.589 -0.732 . . . . 64.510000000000005 109.868 171.347 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -95.65 74.2 3.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.468 0.651 . . . . 64.129999999999995 111.385 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 4.6 mtm180 -127.71 -38.41 1.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.862 -0.608 . . . . 71.510000000000005 109.819 168.299 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.756 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.84 11.78 36.16 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.157 -0.474 . . . . 73.019999999999996 110.874 -176.786 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -64.46 -53.14 52.92 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.679 -0.408 . . . . 74.430000000000007 110.811 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.55 -35.31 80.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 62.310000000000002 110.866 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 276' ' ' MET . . . . . 0.46 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 59.8 mtt -62.73 -43.65 98.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.628 0.727 . . . . 62.210000000000001 109.927 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.628 HD21 ' HD2' ' A' ' 69' ' ' TYR . 28.3 tp -70.25 -41.45 73.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.779 -1.101 . . . . 74.299999999999997 110.514 -178.014 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.14 -46.49 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.544 0.687 . . . . 52.409999999999997 110.102 178.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.08 -24.02 63.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.838 -1.073 . . . . 63.109999999999999 111.669 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.41 -32.15 22.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.998 -0.281 . . . . 71.140000000000001 110.654 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.571 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -60.55 -62.92 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.051 -0.522 . . . . 74.010000000000005 110.598 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.608 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 10.6 pt-20 -74.29 -7.27 52.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.857 -0.611 . . . . 74.329999999999998 112.154 -172.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -58.63 -48.04 82.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.149 0.5 . . . . 71.319999999999993 110.051 174.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -87.5 -15.63 37.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.308 -0.405 . . . . 73.549999999999997 111.197 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.611 HD13 ' HA ' ' A' ' 59' ' ' GLN . 57.5 mt -70.35 -55.95 12.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 C-N-CA 121.019 -0.272 . . . . 72.420000000000002 110.354 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.3 pt-20 -57.8 -30.49 65.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.81 0.338 . . . . 73.439999999999998 111.383 -178.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -94.4 6.75 47.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.334 -0.394 . . . . 72.329999999999998 111.61 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.629 ' O ' ' HB2' ' B' ' 292' ' ' ARG . 69.0 t80 -57.81 -44.71 86.56 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.92 -0.4 . . . . 71.120000000000005 109.92 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -60.87 -32.67 72.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.921 0.391 . . . . 72.219999999999999 110.757 176.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -68.66 -53.77 20.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 65.200000000000003 110.052 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -64.4 -35.81 82.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 74.540000000000006 110.27 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.629 ' HB2' ' O ' ' B' ' 288' ' ' PHE . 0.1 OUTLIER -63.81 -27.84 69.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.565 -0.743 . . . . 75.099999999999994 110.265 177.753 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.17 -17.6 25.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.861 -0.609 . . . . 62.439999999999998 111.282 -176.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 20.4 p -94.32 -3.03 51.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.045 0.45 . . . . 41.539999999999999 111.189 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.417 ' O ' ' HD2' ' B' ' 296' ' ' LYS . 0.0 OUTLIER -116.36 153.36 32.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.024 -0.534 . . . . 72.510000000000005 110.552 179.279 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 296' ' ' LYS . . . . . 0.417 ' HD2' ' O ' ' B' ' 295' ' ' GLN . 30.2 mmmt . . . . . 0 C--O 1.249 1.027 0 CA-C-N 115.239 -0.891 . . . . 72.209999999999994 109.265 178.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.0 p . . . . . 0 N--CA 1.474 0.755 0 CA-C-O 120.636 0.255 . . . . 73.109999999999999 110.702 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -129.5 10.07 5.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.022 0.439 . . . . 64.040000000000006 111.077 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.56 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.4 p-10 -148.02 151.7 36.18 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.224 -0.444 . . . . 73.109999999999999 109.986 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -84.13 -77.29 0.27 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.58 -0.282 . . . . 52.109999999999999 111.253 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -105.34 -50.73 3.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.276 0.56 . . . . 70.519999999999996 109.845 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.56 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -97.28 161.52 13.76 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.476 -0.784 . . . . 64.319999999999993 110.863 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -78.75 53.76 1.41 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.832 -0.622 . . . . 62.340000000000003 112.091 -179.121 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.444 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 28.6 m-85 -53.79 -41.32 67.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.973 0.416 . . . . 71.409999999999997 110.961 -178.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.93 -5.02 31.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.8 -0.636 . . . . 33.140000000000001 112.24 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -99.37 -61.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.771 -0.455 . . . . 72.420000000000002 109.771 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.32 -23.51 24.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.731 -0.668 . . . . 71.030000000000001 112.682 -178.218 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.0 t -65.26 -25.58 67.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.473 0.178 . . . . 71.25 111.06 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.537 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.8 mt-10 -82.16 -33.23 29.62 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.519 0.676 . . . . 63.450000000000003 109.183 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.73 -45.15 91.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.913 -1.04 . . . . 72.299999999999997 109.443 177.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.505 HG23 ' HD2' ' B' ' 243' ' ' TYR . 71.9 mt -68.91 -31.38 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.615 -0.72 . . . . 63.020000000000003 110.682 176.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.48 -38.59 81.24 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.19 -0.459 . . . . 72.209999999999994 110.828 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.627 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 2.0 tm? -67.63 -39.74 84.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 64.540000000000006 110.135 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.585 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -61.2 -25.52 67.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.255 0.55 . . . . 71.549999999999997 110.739 177.3 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.413 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 22.8 m-80 -80.51 -19.97 44.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.987 -0.551 . . . . 54.119999999999997 110.141 178.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.627 ' HG2' ' HA ' ' A' ' 17' ' ' LEU . 27.6 mm-40 -68.33 -51.38 45.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.411 0.624 . . . . 61.200000000000003 109.522 177.1 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -73.82 -14.69 61.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.159 -0.928 . . . . 74.310000000000002 110.362 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -81.18 -11.64 59.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.744 -0.662 . . . . 62.340000000000003 110.854 -178.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 8.6 mm-40 -78.88 64.02 3.73 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.295 0.569 . . . . 73.219999999999999 110.352 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -147.55 149.36 32.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.502 -0.772 . . . . 74.510000000000005 109.053 -178.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.2 t -103.54 -31.77 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 111.979 0.362 . . . . 74.129999999999995 111.979 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -87.29 2.69 49.45 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.155 0.428 . . . . 73.299999999999997 112.155 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.92 148.93 16.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.8 -0.445 . . . . 71.030000000000001 109.8 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.519 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 2.3 mp0 -83.45 146.79 28.21 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.993 -0.548 . . . . 71.420000000000002 109.631 178.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 38.8 m -59.04 -34.79 72.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.125 0.488 . . . . 63.43 110.785 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.4 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -71.86 -11.57 73.94 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.746 -0.661 . . . . 54.240000000000002 113.32 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 13.3 mm-40 -74.54 -23.31 58.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.297 0.57 . . . . 74.400000000000006 110.037 -179.017 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.585 HG11 ' O ' ' A' ' 18' ' ' ALA . 21.2 t -87.3 -39.08 12.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.636 -0.711 . . . . 53.530000000000001 109.834 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -57.56 -42.05 82.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.688 -0.687 . . . . 24.34 110.746 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.11 -31.28 72.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 73.439999999999998 110.908 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.536 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 50.0 m -66.96 -32.3 73.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.159 0.504 . . . . 74.409999999999997 109.901 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.495 ' CD1' HD12 ' B' ' 214' ' ' LEU . 7.1 t80 -68.47 -37.68 80.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 72.519999999999996 109.854 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.779 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 8.5 ttm -66.86 -45.22 78.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 65.329999999999998 111.324 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.661 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 23.7 t-105 -63.1 -38.21 90.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.988 0.423 . . . . 71.219999999999999 110.565 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.509 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -66.39 -36.8 83.76 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.07 -0.514 . . . . 44.109999999999999 111.242 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 61.4 tp -67.68 -35.52 79.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.946 -0.391 . . . . 72.540000000000006 109.946 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.424 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.0 -43.59 98.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.81 -0.632 . . . . 73.209999999999994 110.9 178.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -69.88 -39.15 76.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.025 0.441 . . . . 75.129999999999995 110.708 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -72.41 -32.07 66.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.975 -0.557 . . . . 64.109999999999999 110.497 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 7.1 t-20 -77.31 -39.28 48.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.003 -0.544 . . . . 74.439999999999998 110.722 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.74 -27.59 69.3 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.12 0.486 . . . . 74.319999999999993 111.006 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 18.6 t90 -58.55 -27.77 64.88 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.253 -0.885 . . . . 71.519999999999996 111.072 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.83 -1.72 40.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.544 -0.298 . . . . 74.310000000000002 111.639 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.09 -27.53 69.06 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.463 -0.875 . . . . 72.299999999999997 111.37 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.58 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 33.9 p -67.34 -17.7 64.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 43.43 111.572 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 p -94.52 0.69 55.47 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.958 0.409 . . . . 54.439999999999998 110.894 -177.182 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.4 t -81.17 -39.03 26.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 63.109999999999999 111.59 -175.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.414 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.3 m-85 -154.13 -179.05 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.246 0.461 . . . . 73.239999999999995 112.246 -175.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 54' ' ' THR . 8.9 pt-20 -101.79 -47.32 4.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.41 -0.814 . . . . 75.129999999999995 111.284 -176.315 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.451 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 51.9 p -96.41 154.77 17.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.511 -0.313 . . . . 63.340000000000003 110.358 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.506 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 17.1 ptmt -68.42 -31.16 70.3 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.844 -0.343 . . . . 71.439999999999998 110.287 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.7 mp0 -58.21 -52.24 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.281 0.562 . . . . 75.319999999999993 110.606 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.681 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 95.9 mt-30 -76.91 -36.64 56.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.746 -0.661 . . . . 71.540000000000006 110.541 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.58 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 22.7 ttt -64.86 -43.36 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 70.439999999999998 111.092 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.528 ' HG3' ' NZ ' ' A' ' 62' ' ' LYS . 32.5 tt0 -61.56 -38.68 88.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.021 -0.536 . . . . 74.230000000000004 111.406 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.21 -8.7 57.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.056 -0.52 . . . . 73.400000000000006 111.714 -175.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.681 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.2 mmmm -104.02 -0.24 29.05 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 120.881 -0.328 . . . . 73.329999999999998 111.119 -175.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 6.6 ptpp? -59.52 -48.44 81.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.695 -0.402 . . . . 73.120000000000005 110.607 -176.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.592 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 5.0 tp-100 -73.4 -24.52 60.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.961 -0.385 . . . . 64.319999999999993 109.961 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -71.35 -43.45 66.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 73.310000000000002 111.19 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.2 ptp -75.19 -34.34 61.51 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.911 -0.774 . . . . 63.109999999999999 108.911 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.411 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 63.9 mtp -82.15 1.28 37.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.508 -0.769 . . . . 74.329999999999998 111.289 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 26.1 t0 -78.86 -27.47 44.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.987 0.422 . . . . 75.329999999999998 110.512 -175.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.631 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 24.6 p90 -119.38 -8.59 10.03 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.652 -0.419 . . . . 73.099999999999994 111.258 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.2 m-30 -54.57 -48.34 72.2 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.625 0.25 . . . . 75.400000000000006 111.472 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.782 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -52.3 -57.54 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.994 -0.548 . . . . 74.450000000000003 111.54 177.875 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.493 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 9.1 t70 -91.47 62.74 4.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.952 -0.567 . . . . 61.509999999999998 111.066 -172.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 4.2 mmp_? -120.12 -38.01 2.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 73.25 110.923 175.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.822 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -90.22 12.2 18.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.129 0.49 . . . . 73.019999999999996 109.726 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -51.81 -66.86 0.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.834 -1.076 . . . . 62.109999999999999 111.098 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.0 -23.16 64.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.75 -0.659 . . . . 70.25 112.266 -174.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.434 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 28.2 mtm -78.13 -28.14 48.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.297 0.57 . . . . 71.209999999999994 109.619 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.751 HD21 ' HE2' ' A' ' 81' ' ' MET . 6.6 tt -76.08 -37.59 58.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.438 -0.801 . . . . 74.299999999999997 108.887 174.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.424 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 11.3 t70 -55.76 -39.33 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.055 -0.975 . . . . 71.420000000000002 111.069 178.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.96 -20.32 66.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.283 -0.871 . . . . 70.530000000000001 111.974 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -104.3 -4.47 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 121.065 -0.254 . . . . 54.329999999999998 111.382 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.751 ' HE2' HD21 ' A' ' 77' ' ' LEU . 9.5 mmt -71.56 -35.41 70.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.637 -0.256 . . . . 64.209999999999994 111.611 -178.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.895 ' HA ' HD12 ' A' ' 85' ' ' ILE . 41.2 mt-10 -72.58 4.03 4.34 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.003 0.371 . . . . 74.219999999999999 112.003 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.34 127.2 30.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.401 -0.592 . . . . 51.43 109.401 170.848 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.537 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 23.0 m-85 77.5 -0.12 2.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.83 -1.077 . . . . 63.130000000000003 110.997 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 82' ' ' GLU . 11.2 mt -92.68 -66.02 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.108 -0.496 . . . . 65.510000000000005 109.687 176.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.26 -18.54 65.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.269 0.557 . . . . 63.229999999999997 110.151 176.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -100.8 0.6 39.02 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.617 -0.72 . . . . 71.219999999999999 111.152 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.76 -47.6 85.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 120.589 0.233 . . . . 75.540000000000006 110.614 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -56.41 -24.11 42.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 62.109999999999999 111.412 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -85.3 -55.03 4.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.198 -0.456 . . . . 74.230000000000004 109.924 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -61.42 -40.82 95.83 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.798 0.332 . . . . 72.510000000000005 111.36 -179.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.481 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 6.3 tmm_? -65.84 -17.2 64.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.883 -0.599 . . . . 53.049999999999997 109.809 -178.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -95.04 -39.87 9.94 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.959 -0.564 . . . . 64.420000000000002 110.572 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' A' ' 96' ' ' LYS . 41.5 p -83.59 -1.61 54.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.804 -0.634 . . . . 62.219999999999999 112.228 -176.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -59.87 139.51 57.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.132 0.492 . . . . 73.129999999999995 110.558 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 94' ' ' THR . 95.8 mttt . . . . . 0 C--N 1.321 -0.647 0 CA-C-N 115.829 -0.623 . . . . 74.120000000000005 110.506 -175.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.198 0.523 . . . . 72.430000000000007 109.987 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -90.97 19.08 5.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.498 0.666 . . . . 64.200000000000003 109.266 173.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.592 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 84.4 m-20 -111.2 179.33 4.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.105 -0.952 . . . . 72.239999999999995 111.482 -172.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -120.68 -58.69 1.81 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.32 -0.855 . . . . 75.239999999999995 109.677 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -122.03 -49.06 2.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.104 0.478 . . . . 63.0 110.28 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -99.85 166.63 10.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.798 -0.637 . . . . 55.539999999999999 111.74 -177.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.592 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -78.84 53.99 1.47 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 74.040000000000006 111.708 178.126 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' B' ' 206' ' ' ALA . 71.1 m-85 -54.49 -45.6 73.28 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 72.209999999999994 111.753 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.5 -15.34 62.56 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.431 0.53 . . . . 62.299999999999997 112.431 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -87.74 -62.33 1.52 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.576 0.227 . . . . 75.129999999999995 110.506 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.836 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.6 -18.91 22.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.877 0.695 . . . . 65.420000000000002 112.877 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 212' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 13.6 t -66.76 -23.16 66.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.695 0.284 . . . . 73.019999999999996 110.738 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.493 ' HB2' HD11 ' A' ' 17' ' ' LEU . 79.4 mt-10 -84.55 -27.46 27.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.387 0.613 . . . . 71.530000000000001 109.379 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.836 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -67.23 -47.27 71.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.202 -0.908 . . . . 62.409999999999997 109.598 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 74.6 mt -68.9 -30.92 48.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.661 -0.699 . . . . 65.299999999999997 110.27 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' B' ' 212' ' ' THR . 10.2 tmtt? -56.31 -40.03 73.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.796 -0.638 . . . . 72.120000000000005 110.88 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -64.61 -45.21 87.9 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.576 -0.527 . . . . 73.409999999999997 109.576 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.85 -37.08 78.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.98 -0.555 . . . . 71.099999999999994 110.835 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -74.52 11.56 0.98 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.053 -0.521 . . . . 71.219999999999999 111.757 178.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.11 -37.72 6.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.16 0.505 . . . . 72.25 109.733 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -76.83 -38.32 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 71.540000000000006 110.835 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 222' ' ' ASN . . . . . 0.455 ' CA ' HG21 ' B' ' 232' ' ' VAL . 56.3 t30 -71.29 -14.59 62.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.63 -0.714 . . . . 71.219999999999999 111.55 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -74.71 1.22 12.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.453 -0.34 . . . . 60.439999999999998 111.315 -176.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.492 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.1 t-20 -77.69 103.95 7.94 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.61 -0.885 . . . . 72.200000000000003 108.61 174.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.9 t -58.64 -36.66 74.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.594 -0.73 . . . . 72.109999999999999 112.888 -172.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -82.57 9.55 9.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.964 0.357 . . . . 74.319999999999993 111.964 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.492 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.5 mt -117.28 152.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 109.768 -0.456 . . . . 72.319999999999993 109.768 175.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.0 154.43 28.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.087 -0.506 . . . . 71.239999999999995 110.169 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 229' ' ' THR . . . . . 0.407 ' HA ' ' OD1' ' B' ' 222' ' ' ASN . 5.5 m -64.43 -30.81 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.978 0.418 . . . . 65.049999999999997 110.501 179.037 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -68.05 -18.15 70.58 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.825 -0.625 . . . . 35.32 113.318 -178.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -71.23 -20.21 62.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.991 0.424 . . . . 72.049999999999997 111.078 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 232' ' ' VAL . . . . . 0.455 HG21 ' CA ' ' B' ' 222' ' ' ASN . 28.6 t -99.12 -36.76 5.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.085 -0.507 . . . . 70.450000000000003 110.478 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 35.9 p -64.16 -40.99 97.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.03 0.443 . . . . 64.310000000000002 110.52 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.38 73.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.989 -0.55 . . . . 61.439999999999998 110.554 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.405 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 56.4 m -68.12 -36.49 79.82 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.744 -0.465 . . . . 54.0 109.744 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.53 -40.73 85.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.751 -0.659 . . . . 75.450000000000003 109.58 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.822 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 14.8 ttm -66.25 -44.13 84.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.685 -0.689 . . . . 64.129999999999995 111.457 178.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.444 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 22.7 t-105 -64.31 -38.91 92.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.329999999999998 110.445 176.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.514 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.7 -39.08 93.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.131 -0.486 . . . . 74.200000000000003 111.065 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.17 -35.83 78.65 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.615 -0.513 . . . . 74.409999999999997 109.615 177.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -62.88 -30.65 71.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.175 -0.466 . . . . 61.439999999999998 111.406 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -88.59 -33.25 17.74 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.871 -0.332 . . . . 74.040000000000006 110.949 179.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.505 ' HD2' HG23 ' A' ' 15' ' ' ILE . 10.7 t80 -81.56 -39.64 24.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.392 -0.367 . . . . 72.400000000000006 111.233 -175.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -78.82 -17.43 55.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.047 0.451 . . . . 73.129999999999995 110.975 -175.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -74.75 -13.95 60.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.233 0.539 . . . . 70.129999999999995 110.57 177.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -60.63 -25.93 66.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.513 -0.767 . . . . 65.219999999999999 110.533 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.4 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 63.4 m-85 -72.77 -8.63 56.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.862 -0.608 . . . . 73.450000000000003 111.762 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 248' ' ' GLY . . . . . 0.747 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.03 -36.4 67.34 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.508 -0.853 . . . . 74.219999999999999 111.816 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 43.9 p -69.8 -13.63 62.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.815 0.34 . . . . 72.5 111.831 -177.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 40.0 p -93.03 -9.82 38.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.39 . . . . 72.409999999999997 110.784 -178.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.7 t -76.5 -36.56 57.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.244 -0.435 . . . . 51.530000000000001 110.772 -175.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.403 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 1.4 m-85 -148.88 -178.5 6.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.126 0.489 . . . . 72.010000000000005 111.919 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.527 ' HG3' HG23 ' B' ' 254' ' ' THR . 10.3 pt-20 -103.93 -33.41 8.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.136 -0.938 . . . . 74.310000000000002 111.779 -172.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.536 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 43.2 p -115.09 158.48 22.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.869 -0.605 . . . . 75.450000000000003 110.158 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.77 -36.06 79.81 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 121.052 -0.259 . . . . 63.240000000000002 110.792 -178.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 256' ' ' GLU . . . . . 0.536 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.6 mp0 -58.27 -50.97 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.282 0.563 . . . . 73.25 110.188 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.618 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 97.9 mt-30 -73.05 -40.86 64.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.471 -0.786 . . . . 75.209999999999994 110.82 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.448 ' SD ' HG12 ' A' ' 85' ' ' ILE . 20.1 ttt -63.88 -47.38 80.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 74.319999999999993 111.24 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.547 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.7 tt0 -62.0 -34.48 76.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 63.240000000000002 110.909 -178.191 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.32 -6.77 48.24 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.113 -0.494 . . . . 45.240000000000002 111.58 -178.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.618 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 13.9 mmmm -114.59 5.49 15.47 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 122.362 -0.211 . . . . 53.020000000000003 110.608 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.473 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 1.6 ptpp? -52.55 -48.34 66.19 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 123.314 0.384 . . . . 64.409999999999997 110.785 -177.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 16.1 tp60 -77.78 -28.36 50.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.99 0.424 . . . . 62.409999999999997 110.055 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.67 -38.17 83.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.748 -0.66 . . . . 61.100000000000001 111.187 -177.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.747 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 16.8 ptp -84.44 -26.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.307 0.575 . . . . 74.109999999999999 109.83 -177.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.523 ' HG2' HD22 ' A' ' 77' ' ' LEU . 75.0 mtp -79.1 -20.46 48.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.643 -0.708 . . . . 70.140000000000001 111.758 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.41 -34.95 74.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 75.200000000000003 111.369 -168.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -102.79 -10.61 18.97 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.787 -0.365 . . . . 74.439999999999998 111.179 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -60.35 -48.13 83.08 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.477 0.18 . . . . 51.399999999999999 111.173 -178.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.81 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -51.65 -51.77 53.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.059 -0.519 . . . . 75.519999999999996 111.088 177.067 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 271' ' ' ASP . . . . . 0.662 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 10.4 t70 -92.2 28.75 1.81 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.831 -0.622 . . . . 45.109999999999999 111.558 -171.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -84.28 -48.28 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.945 -0.472 . . . . 73.540000000000006 110.765 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.782 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -83.85 10.49 9.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.113 -0.494 . . . . 74.510000000000005 110.981 -174.822 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 14.4 tttp -56.07 -60.57 3.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.946 -0.57 . . . . 73.430000000000007 110.782 -177.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 275' ' ' GLU . . . . . 0.473 ' HG3' ' N ' ' B' ' 276' ' ' MET . 6.0 pt-20 -56.82 -39.83 74.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.602 -0.726 . . . . 74.120000000000005 111.842 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 276' ' ' MET . . . . . 0.661 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 49.3 mtm -74.66 -26.21 59.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.044 0.45 . . . . 44.119999999999997 110.548 -176.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 5.2 tt -72.41 -41.69 65.96 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.711 -0.848 . . . . 75.549999999999997 108.711 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 278' ' ' ASP . . . . . 0.411 ' N ' ' HE1' ' A' ' 66' ' ' MET . 8.7 t70 -61.37 -38.68 87.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.237 -0.892 . . . . 71.019999999999996 110.815 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -64.39 -17.35 63.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.656 -0.702 . . . . 35.200000000000003 111.779 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -101.09 -3.37 29.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.758 0.313 . . . . 71.530000000000001 111.283 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.41 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.1 mmt -76.38 -176.03 3.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.242 -0.435 . . . . 73.420000000000002 110.675 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.769 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 4.0 mm-40 61.54 14.81 6.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.483 -0.78 . . . . 75.109999999999999 111.901 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -66.76 -58.84 4.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.201 -0.454 . . . . 63.539999999999999 110.676 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -89.29 -7.46 55.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.977 0.417 . . . . 72.540000000000006 110.002 174.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.769 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 42.7 mt -75.44 -57.88 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.087 -0.506 . . . . 74.319999999999993 111.318 -175.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.5 pt-20 -73.03 -16.71 61.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.838 0.351 . . . . 72.239999999999995 110.595 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 287' ' ' ASN . . . . . 0.403 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 56.4 m-80 -109.19 22.19 16.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.289 -0.414 . . . . 64.430000000000007 110.516 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.506 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 25.3 t80 -58.6 -56.78 17.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.47 -0.332 . . . . 75.329999999999998 110.826 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -60.42 -21.19 61.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.536 -0.302 . . . . 73.519999999999996 111.364 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -69.77 -57.61 4.9 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.778 -0.452 . . . . 73.129999999999995 109.778 178.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -70.67 -28.61 64.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.067 -0.515 . . . . 71.019999999999996 110.495 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.468 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 7.8 tmm_? -72.0 -15.09 62.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.455 -0.793 . . . . 70.510000000000005 110.03 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.08 -39.05 12.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.042 0.449 . . . . 71.319999999999993 110.264 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 39.7 p -94.14 22.84 5.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.879 -0.6 . . . . 73.319999999999993 111.197 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -72.55 135.27 45.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.766 -0.652 . . . . 63.399999999999999 110.602 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 96.0 mttt . . . . . 0 C--N 1.314 -0.964 0 CA-C-O 118.296 -0.859 . . . . 74.200000000000003 109.757 -178.976 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 120.619 0.247 . . . . 74.109999999999999 110.36 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -81.39 -12.51 58.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.041 0.448 . . . . 53.0 110.233 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.697 ' HA ' ' HB2' ' A' ' 8' ' ' TYR . 1.6 p-10 -148.65 121.12 8.5 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.759 -0.83 . . . . 74.310000000000002 108.759 170.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.461 ' H ' ' HD2' ' A' ' 8' ' ' TYR . 24.8 mt-10 -104.33 79.08 1.55 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.25 -0.432 . . . . 62.030000000000001 111.544 -175.01 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.43 24.67 8.77 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.125 0.965 . . . . 75.219999999999999 108.735 175.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -158.3 174.91 14.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.41 -1.268 . . . . 71.030000000000001 110.222 -171.053 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -91.49 42.4 1.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.308 -0.405 . . . . 64.310000000000002 111.526 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.697 ' HB2' ' HA ' ' A' ' 3' ' ' ASN . 44.5 m-85 -53.34 -46.3 69.46 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.413 -0.358 . . . . 54.130000000000003 111.193 178.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.12 -14.91 62.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.95 -0.568 . . . . 51.009999999999998 111.914 -178.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 0.6 OUTLIER -95.36 -58.02 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.257 -0.275 . . . . 72.420000000000002 110.257 178.905 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.889 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -57.16 -23.14 45.44 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.688 0.625 . . . . 51.530000000000001 112.688 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 t -65.39 -24.01 67.11 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.941 0.401 . . . . 70.040000000000006 110.801 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.544 ' HB2' HD11 ' B' ' 217' ' ' LEU . 35.9 mt-10 -81.34 -23.28 37.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.332 0.586 . . . . 73.209999999999994 109.878 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.889 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -71.14 -41.68 70.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.333 -0.848 . . . . 75.030000000000001 109.591 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.425 HG23 ' HD2' ' B' ' 243' ' ' TYR . 71.4 mt -72.67 -20.58 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.657 -0.701 . . . . 75.310000000000002 110.192 177.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 15.7 mmmt -57.96 -40.08 79.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.708 -0.678 . . . . 70.310000000000002 111.851 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' B' ' 213' ' ' GLU . 2.7 tm? -74.98 -29.73 60.98 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.267 0.556 . . . . 72.439999999999998 109.527 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.418 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -70.4 -42.95 71.02 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.585 -0.734 . . . . 51.5 110.698 -175.113 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.655 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.8 m-20 -57.05 -42.45 80.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.893 -0.594 . . . . 64.109999999999999 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.92 -33.96 75.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.939 -0.573 . . . . 75.519999999999996 111.745 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -77.62 -27.99 51.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.001 0.429 . . . . 74.140000000000001 110.199 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.498 ' HA ' HG21 ' A' ' 32' ' ' VAL . 52.7 t30 -74.7 -20.28 59.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.94 -0.573 . . . . 74.140000000000001 110.383 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 9.9 mm-40 -71.91 -15.58 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.962 -0.563 . . . . 64.219999999999999 111.296 -178.533 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.616 ' HB3' HG13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -66.69 123.51 20.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.963 0.411 . . . . 61.450000000000003 110.569 -177.226 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.2 t -56.98 -37.2 71.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.368 -0.833 . . . . 74.239999999999995 113.039 -175.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -82.74 -24.09 33.71 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.852 0.316 . . . . 75.0 111.852 -173.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.616 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.5 mt -90.68 145.11 7.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.095 0.474 . . . . 70.120000000000005 110.276 -174.34 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.708 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 33.4 mt-30 -83.73 152.65 24.59 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.322 -0.854 . . . . 71.319999999999993 109.358 177.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.445 ' HA ' ' OD1' ' A' ' 22' ' ' ASN . 30.2 m -58.3 -37.7 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.033 0.445 . . . . 72.0 110.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.844 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -69.39 -19.08 74.08 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.6 -0.727 . . . . 72.25 114.078 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.708 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 33.7 mm-40 -74.92 -36.09 62.17 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 117.588 0.694 . . . . 71.310000000000002 109.606 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.498 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.5 t -71.92 -41.04 69.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.312 -0.858 . . . . 74.209999999999994 110.353 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -59.38 -37.08 77.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.714 -0.675 . . . . 73.209999999999994 110.369 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.64 -31.48 65.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.798 -0.637 . . . . 72.010000000000005 110.872 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.483 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 10.3 t -68.33 -37.54 80.64 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.694 -0.484 . . . . 72.0 109.694 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.616 ' HD1' HD12 ' B' ' 214' ' ' LEU . 13.7 t80 -66.89 -37.47 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 72.109999999999999 109.545 176.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.731 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.4 ttm -67.33 -46.63 72.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 61.020000000000003 111.412 178.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.631 ' HE3' ' HB3' ' B' ' 276' ' ' MET . 35.8 t-105 -62.24 -39.93 94.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.739 0.304 . . . . 72.319999999999993 110.727 177.469 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.522 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -63.14 -37.89 88.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.362 -0.381 . . . . 72.099999999999994 111.038 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.753 HD21 ' SD ' ' B' ' 237' ' ' MET . 56.4 tp -64.94 -37.93 89.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 120.955 0.407 . . . . 70.5 110.075 178.447 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.549 ' HB1' ' HA ' ' B' ' 277' ' ' LEU . . . -63.16 -35.41 80.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.797 -0.638 . . . . 74.430000000000007 111.25 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 38' ' ' TRP . 55.9 mtp180 -74.81 -37.45 62.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.258 0.551 . . . . 74.120000000000005 110.142 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -77.39 -41.25 40.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.471 -0.786 . . . . 75.530000000000001 110.911 -175.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -66.05 -34.74 78.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.945 -0.57 . . . . 52.409999999999997 110.862 -175.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.403 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -62.37 -11.07 13.44 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.851 -0.613 . . . . 71.209999999999994 112.471 -177.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -63.27 -26.99 69.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.666 0.27 . . . . 73.329999999999998 111.087 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -66.53 -11.87 54.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.446 -0.343 . . . . 65.219999999999999 111.856 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.48 -28.01 66.78 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.274 -0.965 . . . . 75.430000000000007 111.233 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.9 m -64.17 -15.83 60.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.474 0.31 . . . . 73.540000000000006 111.657 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.9 t -119.15 22.19 11.95 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.153 0.501 . . . . 72.140000000000001 110.698 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.1 t -84.59 -60.88 1.93 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.45 -0.341 . . . . 74.329999999999998 110.814 178.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.536 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.8 m-85 -146.48 -175.29 4.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.814 0.34 . . . . 75.319999999999993 111.387 -177.035 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -102.1 -33.13 9.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.575 -0.739 . . . . 61.030000000000001 111.241 -174.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 p -113.01 153.02 28.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.897 -0.592 . . . . 73.010000000000005 110.804 -178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -67.37 -34.04 76.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.403 -0.362 . . . . 64.099999999999994 110.755 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.23 -36.44 84.15 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.247 -0.433 . . . . 53.039999999999999 111.001 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.663 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 98.9 mt-30 -84.84 -40.16 17.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.448 -0.342 . . . . 62.350000000000001 110.468 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' HG12 ' B' ' 285' ' ' ILE . 19.4 ttt -64.4 -45.1 89.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.234 -0.439 . . . . 73.010000000000005 111.425 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.603 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.2 tt0 -64.25 -33.44 75.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 63.329999999999998 110.993 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.47 -17.84 62.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.238 -0.437 . . . . 74.329999999999998 110.898 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.663 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.3 mmmt -100.44 -2.3 33.62 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.262 -0.426 . . . . 54.219999999999999 109.904 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.594 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 27.2 ttpp -53.54 -51.77 61.84 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.239 -0.437 . . . . 41.409999999999997 111.31 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -80.41 -11.22 59.72 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.318 -0.553 . . . . 65.319999999999993 110.45 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -83.49 -27.78 29.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.312 -0.404 . . . . 74.209999999999994 110.012 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.594 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 19.0 ptp -88.9 -33.23 17.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.353 -0.981 . . . . 71.450000000000003 108.353 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 61.6 mtp -85.56 14.66 5.34 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 115.402 -0.817 . . . . 74.140000000000001 111.144 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -87.37 -39.57 15.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.182 0.515 . . . . 54.219999999999999 110.321 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.646 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 39.2 p90 -103.59 -9.89 18.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.098 -0.501 . . . . 73.420000000000002 111.758 -173.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.416 ' O ' ' HE1' ' B' ' 237' ' ' MET . 11.6 m-30 -56.74 -48.94 76.67 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.864 0.364 . . . . 63.439999999999998 110.902 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.869 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.24 -47.03 72.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.53 0.681 . . . . 74.409999999999997 110.101 176.459 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -82.93 34.49 0.45 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.017 -0.992 . . . . 73.150000000000006 110.975 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.682 ' HA ' ' NE ' ' A' ' 72' ' ' ARG . 2.1 mmp_? -107.76 -32.57 7.57 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.982 -0.449 . . . . 75.230000000000004 110.995 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.805 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -107.08 3.61 26.04 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.348 -0.541 . . . . 72.129999999999995 110.027 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.433 ' HB2' ' HG2' ' B' ' 270' ' ' MET . 82.2 tttt -63.96 -54.04 40.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.025 -0.534 . . . . 53.399999999999999 110.748 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -62.6 -24.79 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.906 -0.588 . . . . 63.539999999999999 111.499 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.613 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 64.1 mtm -90.89 -23.0 20.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.022 0.439 . . . . 73.120000000000005 110.456 -179.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.421 HD13 ' HE1' ' B' ' 270' ' ' MET . 6.2 tt -73.16 -38.65 66.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.755 -0.832 . . . . 72.099999999999994 108.755 176.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.439 ' N ' ' HE1' ' B' ' 266' ' ' MET . 26.8 t70 -60.32 -31.88 70.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.321 -0.854 . . . . 72.150000000000006 110.588 178.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.59 -14.29 60.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.602 -0.726 . . . . 62.100000000000001 111.621 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -97.44 -9.96 26.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.224 0.535 . . . . 71.129999999999995 110.641 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.45 -169.64 1.05 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.891 -0.595 . . . . 74.340000000000003 110.276 174.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.556 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 64.17 -11.03 0.13 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.876 1.065 . . . . 64.319999999999993 113.876 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -53.57 -62.64 1.52 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.735 0.302 . . . . 52.329999999999998 111.457 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -81.99 5.68 18.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.756 0.313 . . . . 72.510000000000005 111.019 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.595 HG21 ' HB2' ' B' ' 259' ' ' GLN . 51.6 mt -97.74 -59.7 3.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.42 -0.354 . . . . 73.530000000000001 111.258 -175.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.4 pt-20 -71.88 -18.49 62.04 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.567 -0.453 . . . . 73.439999999999998 110.884 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -97.37 1.39 49.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.278 -0.419 . . . . 64.239999999999995 110.481 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -63.01 -38.43 91.18 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.658 -0.497 . . . . 70.319999999999993 109.658 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -53.63 -35.86 61.4 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.622 -0.717 . . . . 64.510000000000005 110.432 174.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -76.95 -53.24 8.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.582 -0.735 . . . . 72.540000000000006 110.317 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -58.22 -46.78 85.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.477 . . . . 74.219999999999999 111.41 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 tpp180 -67.86 -14.98 63.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.957 -0.565 . . . . 75.450000000000003 110.867 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -91.78 -34.01 14.76 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.139 -0.482 . . . . 52.229999999999997 110.748 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.7 p -78.52 -18.4 54.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.045 -0.525 . . . . 74.239999999999995 112.074 -177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -98.56 129.2 45.1 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.38 0.609 . . . . 71.129999999999995 110.865 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 115.535 -0.757 . . . . 72.420000000000002 110.981 -176.83 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.455 -0.186 0 N-CA-C 110.115 -0.328 . . . . 74.409999999999997 110.115 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -88.08 -10.83 48.9 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.399 0.618 . . . . 72.549999999999997 110.378 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 26.1 p-10 -112.44 159.61 18.57 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.362 -0.835 . . . . 73.25 110.458 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 204' ' ' GLU . . . . . 0.529 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . 42.3 tt0 -114.2 74.27 0.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.168 0.508 . . . . 54.100000000000001 110.545 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 68.55 19.95 8.53 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.095 -0.957 . . . . 71.120000000000005 109.54 173.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.514 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -151.53 167.04 29.29 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.291 -0.868 . . . . 74.430000000000007 111.325 -170.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.483 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -90.59 45.65 1.28 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.811 -0.631 . . . . 71.340000000000003 111.066 -179.154 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.529 ' CE2' ' HB3' ' B' ' 204' ' ' GLU . 69.3 m-85 -49.07 -49.54 41.05 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.357 -0.383 . . . . 62.350000000000001 111.476 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.44 -34.8 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.142 -0.481 . . . . 70.519999999999996 111.819 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 10.5 mmp_? -68.69 -59.27 3.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.462 -0.335 . . . . 62.25 110.223 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.77 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -61.92 -17.66 57.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.888 -0.597 . . . . 72.329999999999998 111.593 -176.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 212' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 24.3 m -60.43 -34.4 73.93 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.633 -0.712 . . . . 70.209999999999994 110.921 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.537 ' HB2' HD11 ' A' ' 17' ' ' LEU . 32.2 mt-10 -81.1 -25.42 36.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 61.140000000000001 110.18 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.77 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.7 mm? -66.52 -41.22 89.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.641 -0.708 . . . . 74.530000000000001 110.209 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 93.2 mt -73.99 -18.58 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.898 -0.592 . . . . 64.510000000000005 111.194 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 212' ' ' THR . 31.2 mmmt -62.47 -40.53 96.95 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.042 -0.411 . . . . 71.099999999999994 111.043 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.2 tm? -65.79 -34.78 78.96 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.391 -0.596 . . . . 71.519999999999996 109.391 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.14 93.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.885 -0.598 . . . . 74.420000000000002 110.36 -178.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.563 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 24.4 m-80 -60.84 -35.07 75.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.961 -0.563 . . . . 73.430000000000007 110.678 178.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.08 -28.69 63.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 75.219999999999999 111.663 -179.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -84.22 -22.66 30.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.403 0.621 . . . . 53.240000000000002 110.032 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 222' ' ' ASN . . . . . 0.478 ' HA ' HG21 ' B' ' 232' ' ' VAL . 64.9 t30 -75.84 -8.56 57.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.271 -0.877 . . . . 73.209999999999994 109.94 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.563 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 10.9 mm-40 -83.32 1.23 42.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.793 -0.64 . . . . 55.509999999999998 110.653 177.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 224' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.33 111.62 22.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.356 -0.383 . . . . 73.120000000000005 110.157 -178.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.0 t -65.59 -36.69 84.5 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.986 0.736 . . . . 74.439999999999998 112.986 -173.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.69 -9.94 59.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.091 0.404 . . . . 54.409999999999997 112.091 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.563 HG22 ' HB2' ' B' ' 231' ' ' GLU . 7.0 mt -101.15 145.06 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.541 -0.54 . . . . 43.310000000000002 109.541 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.75 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 38.0 mt-30 -78.55 150.45 32.83 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.958 -0.564 . . . . 75.329999999999998 109.726 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -35.92 72.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.912 0.387 . . . . 40.450000000000003 110.519 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.71 -16.5 76.14 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.791 -0.641 . . . . 64.150000000000006 113.355 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.75 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 9.3 mm-40 -76.87 -31.33 56.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 117.477 0.639 . . . . 72.209999999999994 110.103 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 232' ' ' VAL . . . . . 0.478 HG21 ' HA ' ' B' ' 222' ' ' ASN . 22.0 t -72.05 -31.51 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.699 0.761 . . . . 62.439999999999998 109.762 178.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.14 -29.47 66.4 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.521 -0.763 . . . . 73.349999999999994 109.665 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.39 -33.41 37.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.592 -0.731 . . . . 65.219999999999999 111.424 -177.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 10.5 p -66.53 -36.74 83.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.096 -0.335 . . . . 71.200000000000003 110.096 178.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.57 ' CD1' HD12 ' A' ' 14' ' ' LEU . 3.2 t80 -65.78 -38.06 87.99 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.381 -0.6 . . . . 71.040000000000006 109.381 174.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.805 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.2 tpt -61.4 -54.38 44.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.232 -0.894 . . . . 72.430000000000007 110.639 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.613 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 27.2 t-105 -64.01 -36.58 84.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.517 -0.765 . . . . 71.310000000000002 111.421 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -62.01 -43.46 98.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.658 0.266 . . . . 72.109999999999999 110.744 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.01 -37.94 89.2 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.481 -0.327 . . . . 71.420000000000002 110.446 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.551 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -57.91 -39.99 79.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.475 -0.33 . . . . 51.030000000000001 111.347 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -75.02 -43.14 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.306 0.574 . . . . 74.420000000000002 110.283 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.425 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.5 t80 -69.81 -30.25 67.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.497 -0.774 . . . . 71.5 110.895 -175.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -79.87 -38.52 32.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.045 -0.525 . . . . 73.430000000000007 111.082 -175.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.14 -18.52 48.2 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.97 -0.559 . . . . 64.140000000000001 111.834 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -54.79 -34.22 62.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.789 -0.641 . . . . 63.420000000000002 111.227 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.844 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 41.5 m-85 -67.5 -15.08 63.48 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 112.12 0.415 . . . . 75.349999999999994 112.12 -176.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 248' ' ' GLY . . . . . 0.639 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -55.99 -31.09 58.33 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.596 -0.812 . . . . 54.100000000000001 112.143 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 62.2 p -74.19 -14.23 60.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.722 0.296 . . . . 74.430000000000007 111.455 -177.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 34.0 p -98.21 -5.96 32.24 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.848 0.356 . . . . 63.210000000000001 111.119 -176.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 67.3 m -78.89 -41.97 28.38 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 116.137 -0.483 . . . . 73.409999999999997 111.647 -175.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.627 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 3.0 m-85 -147.06 176.61 9.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.235 0.457 . . . . 71.030000000000001 112.235 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -101.09 -46.6 5.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.36 -0.836 . . . . 75.549999999999997 111.611 -172.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 40.9 p -100.63 151.19 21.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.52 -0.309 . . . . 65.129999999999995 110.287 -177.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -63.29 -36.29 83.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.126 -0.488 . . . . 74.510000000000005 111.075 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.74 -29.36 69.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.027 -0.533 . . . . 73.040000000000006 111.075 -176.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.758 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 98.6 mt-30 -91.25 -45.04 8.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 70.340000000000003 110.159 177.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 16.8 ttt -60.5 -41.93 95.3 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.952 -0.567 . . . . 73.140000000000001 111.552 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.595 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.6 tt0 -64.48 -40.09 95.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.83 0.348 . . . . 74.129999999999995 111.329 -178.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.54 -4.78 24.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.174 0.512 . . . . 52.009999999999998 110.954 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.758 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 71.9 mmtt -108.35 4.85 24.93 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.059 -0.519 . . . . 71.219999999999999 110.61 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.594 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 2.6 ptpp? -60.18 -49.46 77.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.399 -0.52 . . . . 72.319999999999993 110.225 -177.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.569 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 7.2 tp-100 -86.02 -1.32 57.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.555 0.693 . . . . 72.340000000000003 110.074 -179.211 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 264' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' B' ' 261' ' ' LYS . 4.1 tp10 -79.74 -43.44 22.59 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.821 -0.627 . . . . 74.219999999999999 109.324 173.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.639 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 3.8 ptt? -86.37 -31.62 21.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.941 0.4 . . . . 74.140000000000001 110.204 177.462 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.44 ' HB2' ' HA ' ' B' ' 263' ' ' GLN . 60.6 mtp -77.31 7.84 4.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.403 -0.362 . . . . 64.519999999999996 110.952 177.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -78.79 -42.6 27.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.095 0.474 . . . . 61.219999999999999 110.067 176.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.9 p90 -107.65 -12.93 15.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 73.319999999999993 111.751 -172.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 -51.88 -51.6 55.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.791 0.329 . . . . 74.310000000000002 111.199 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.869 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.87 -49.04 78.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.365 0.603 . . . . 72.219999999999999 110.228 177.316 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -87.27 42.02 1.01 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.207 -0.906 . . . . 61.329999999999998 110.647 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -104.61 -42.3 5.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.419 -0.355 . . . . 60.43 110.455 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.731 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -93.32 9.65 35.4 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.503 -0.479 . . . . 65.200000000000003 110.769 -175.531 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -63.93 -48.75 75.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.929 0.395 . . . . 60.439999999999998 110.426 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -67.66 -25.88 65.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.448 0.642 . . . . 75.030000000000001 110.737 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 276' ' ' MET . . . . . 0.631 ' HB3' ' HE3' ' A' ' 38' ' ' TRP . 56.0 mmm -83.45 -28.12 29.01 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.265 -0.88 . . . . 74.019999999999996 109.792 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.549 ' HA ' ' HB1' ' A' ' 41' ' ' ALA . 1.9 tt -72.62 -41.74 65.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.353 -0.84 . . . . 64.120000000000005 108.946 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -61.01 -31.43 71.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.504 -0.771 . . . . 73.310000000000002 110.123 176.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -71.94 -7.52 49.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.265 -0.88 . . . . 75.209999999999994 111.848 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -114.35 -8.22 12.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.95 0.405 . . . . 74.430000000000007 110.96 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.511 ' C ' ' H ' ' B' ' 283' ' ' ASP . 39.9 mtt -87.85 -162.77 0.85 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.269 -0.423 . . . . 73.129999999999995 110.248 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 5.0 mm-40 65.43 -22.9 0.09 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.79 0.836 . . . . 74.25 112.75 -176.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 283' ' ' ASP . . . . . 0.511 ' H ' ' C ' ' B' ' 281' ' ' MET . 20.6 t70 -48.03 -63.48 1.06 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.322 0.649 . . . . 71.319999999999993 111.883 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -68.0 -32.15 72.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.029 0.442 . . . . 54.43 110.813 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.603 HG21 ' HB2' ' A' ' 59' ' ' GLN . 46.0 mt -65.25 -56.96 12.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.666 -0.697 . . . . 75.230000000000004 111.52 -173.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 13.4 pt-20 -65.72 -21.01 66.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.848 0.356 . . . . 74.200000000000003 110.906 -177.702 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 287' ' ' ASN . . . . . 0.403 ' O ' ' HB3' ' B' ' 290' ' ' HIS . 45.4 m-80 -102.1 9.18 40.47 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 74.329999999999998 112.272 -177.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -58.38 -52.94 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.53 -0.468 . . . . 72.129999999999995 110.325 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -68.54 -18.3 64.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 52.329999999999998 110.954 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 290' ' ' HIS . . . . . 0.403 ' HB3' ' O ' ' B' ' 287' ' ' ASN . 4.7 t60 -72.67 -56.48 5.24 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.865 -0.607 . . . . 64.319999999999993 109.877 173.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -64.0 -43.13 96.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.925 0.393 . . . . 54.25 110.907 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.635 ' HA ' ' HG2' ' B' ' 295' ' ' GLN . 8.0 tpp180 -73.95 -0.64 16.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.216 0.532 . . . . 73.420000000000002 110.959 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -96.33 -23.04 16.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.096 0.474 . . . . 51.399999999999999 110.449 174.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.6 p -90.85 -12.72 35.44 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.433 0.635 . . . . 75.109999999999999 110.221 176.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.635 ' HG2' ' HA ' ' B' ' 292' ' ' ARG . 19.2 pt20 -123.28 176.32 6.18 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.338 -0.986 . . . . 75.340000000000003 108.338 175.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt . . . . . 0 C--N 1.314 -0.946 0 CA-C-O 118.707 -0.663 . . . . 74.239999999999995 110.421 -178.51 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 121.296 0.57 . . . . 73.310000000000002 110.696 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -148.86 -53.07 0.17 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.455 -0.943 . . . . 61.100000000000001 108.455 174.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.9 p-10 -123.42 120.6 33.45 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.786 -0.643 . . . . 62.420000000000002 109.29 174.143 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -63.8 -57.59 9.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.613 -0.721 . . . . 74.120000000000005 110.517 -178.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -136.96 -56.61 0.72 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.987 0.423 . . . . 74.420000000000002 109.998 175.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -68.25 167.1 15.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.78 -0.646 . . . . 60.329999999999998 111.652 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.406 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -79.1 49.56 0.96 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.219 -0.9 . . . . 72.340000000000003 111.845 -178.127 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.411 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 54.2 m-85 -53.31 -42.42 66.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 73.400000000000006 110.972 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.4 -9.38 47.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.68 -0.691 . . . . 74.439999999999998 112.222 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.509 ' HE ' ' HA ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -98.54 -62.21 1.27 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.745 -0.465 . . . . 74.209999999999994 109.745 178.598 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.721 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.24 -23.88 24.8 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.743 0.646 . . . . 73.439999999999998 112.743 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.7 t -66.43 -24.92 66.53 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.738 0.304 . . . . 72.400000000000006 110.887 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.59 ' HB2' HD11 ' B' ' 217' ' ' LEU . 31.2 mt-10 -80.75 -31.17 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.481 0.658 . . . . 63.210000000000001 109.528 -177.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -67.16 -48.73 67.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.03 -0.986 . . . . 75.019999999999996 110.144 -178.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.451 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.0 mt -65.82 -29.11 45.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 74.400000000000006 110.53 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -25.88 65.37 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.98 -0.555 . . . . 71.430000000000007 110.681 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.564 HD12 HD13 ' B' ' 214' ' ' LEU . 2.4 tm? -75.42 -45.94 35.76 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.86 -0.792 . . . . 45.520000000000003 108.86 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.45 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -59.87 -37.54 79.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.519 0.676 . . . . 73.209999999999994 109.692 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 7.7 t-20 -56.58 -30.39 63.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.775 -1.102 . . . . 51.140000000000001 110.529 177.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -78.24 -35.07 48.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.772 . . . . 73.340000000000003 110.992 -176.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -79.2 -23.33 43.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.196 -0.456 . . . . 72.219999999999999 110.999 -176.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -86.89 7.51 26.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.238 0.542 . . . . 72.430000000000007 110.499 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 87.0 mm-40 -79.3 8.24 6.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 72.420000000000002 111.184 177.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.745 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.3 t-20 -101.94 111.9 24.33 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.426 -0.583 . . . . 73.129999999999995 109.426 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.6 t -56.03 -33.51 64.99 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.382 -0.826 . . . . 65.450000000000003 112.626 -175.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -95.68 13.79 25.23 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.438 0.533 . . . . 75.140000000000001 112.438 -173.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.745 HG13 ' HB3' ' A' ' 24' ' ' ASN . 5.7 mt -111.78 150.25 14.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.542 -0.54 . . . . 74.140000000000001 109.542 172.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.858 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 42.6 mt-30 -72.47 144.26 48.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.958 -0.564 . . . . 74.25 109.976 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 m -63.66 -26.32 68.61 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.228 -0.656 . . . . 61.119999999999997 109.228 175.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.47 ' HA2' ' OG ' ' A' ' 33' ' ' SER . . . -78.65 -8.03 87.87 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.195 -0.912 . . . . 63.100000000000001 113.122 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.858 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 12.6 mm-40 -78.64 -25.72 45.04 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.437 0.619 . . . . 72.530000000000001 109.859 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.45 HG11 ' O ' ' A' ' 18' ' ' ALA . 16.2 t -93.46 -31.49 4.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.353 -0.84 . . . . 70.439999999999998 110.762 -176.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.47 ' OG ' ' HA2' ' A' ' 30' ' ' GLY . 10.2 p -66.71 -37.15 84.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.245 0.545 . . . . 64.239999999999995 109.844 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.9 65.05 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.474 -0.785 . . . . 73.439999999999998 111.446 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.51 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 20.1 p -70.54 -31.79 68.97 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.905 0.383 . . . . 53.409999999999997 110.187 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.591 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.9 t80 -68.81 -41.35 78.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.879 -0.6 . . . . 72.209999999999994 109.456 174.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.752 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.1 ttm -64.06 -47.42 80.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.549 -0.75 . . . . 75.319999999999993 111.158 177.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.7 t-105 -61.31 -37.43 83.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.067 0.46 . . . . 75.439999999999998 110.751 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.572 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -68.93 -34.13 74.87 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.277 -0.42 . . . . 63.399999999999999 111.199 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.608 HD21 ' SD ' ' B' ' 237' ' ' MET . 48.8 tp -68.9 -35.94 77.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.017 0.437 . . . . 74.400000000000006 110.222 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.03 -42.87 99.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.869 -0.605 . . . . 53.219999999999999 110.72 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.409 ' NH2' HD12 ' B' ' 215' ' ' ILE . 47.7 mtm180 -71.94 -19.98 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 71.230000000000004 111.036 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -89.18 -42.13 11.84 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.307 -0.406 . . . . 63.009999999999998 110.462 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -69.71 -23.54 63.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 71.109999999999999 111.568 -179.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.37 61.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.144 0.497 . . . . 73.239999999999995 111.477 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -68.63 -31.46 70.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.025 -0.534 . . . . 71.430000000000007 110.881 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.453 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 91.1 m-85 -79.01 2.37 20.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.187 -0.461 . . . . 73.439999999999998 112.049 -173.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.445 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -59.03 -34.51 79.48 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.486 -0.864 . . . . 72.230000000000004 112.101 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.7 p -74.36 -14.83 60.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.765 0.317 . . . . 52.310000000000002 111.597 -177.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -88.5 -4.04 58.69 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.734 -0.386 . . . . 54.43 110.713 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.0 t -84.82 -36.97 21.28 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.371 -0.377 . . . . 74.140000000000001 110.756 -176.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -151.5 178.2 9.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.98 0.419 . . . . 75.409999999999997 111.311 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.407 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.5 pt-20 -99.43 -50.11 4.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.581 -0.736 . . . . 75.109999999999999 110.985 -176.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.407 HG23 ' HG3' ' A' ' 53' ' ' GLU . 63.0 p -92.25 150.52 20.83 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.156 -0.475 . . . . 74.129999999999995 110.323 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.426 ' HB2' ' HE2' ' A' ' 55' ' ' LYS . 11.2 ptmm? -68.09 -27.98 66.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.714 -0.394 . . . . 73.310000000000002 110.142 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.401 ' H ' ' CD ' ' A' ' 56' ' ' GLU . 1.7 mp0 -56.15 -54.84 40.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 73.319999999999993 110.465 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 90.0 mt-30 -77.38 -34.43 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.824 -0.625 . . . . 62.340000000000003 110.31 -177.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.421 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 20.4 ttt -63.68 -44.61 93.19 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.467 -0.788 . . . . 63.420000000000002 111.079 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.507 ' O ' ' HD2' ' A' ' 62' ' ' LYS . 35.6 tt0 -68.47 -28.6 67.18 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 73.340000000000003 111.234 -176.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.6 -6.68 51.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.494 -0.321 . . . . 44.530000000000001 111.801 -177.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.561 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 11.3 mmmm -112.83 10.06 19.06 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.683 -0.488 . . . . 72.409999999999997 109.683 -176.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HD2' ' O ' ' A' ' 59' ' ' GLN . 9.6 ptmt -51.27 -41.16 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.379 -0.828 . . . . 65.129999999999995 111.421 -177.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -87.76 -30.39 20.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.512 0.196 . . . . 74.109999999999999 110.622 -175.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.08 -37.17 86.14 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 116.377 -0.374 . . . . 71.030000000000001 111.302 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.451 ' HA ' ' CE2' ' A' ' 68' ' ' TYR . 23.2 ptp -83.27 -31.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.77 -0.826 . . . . 73.150000000000006 108.77 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.529 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 21.3 mtp -86.63 33.86 0.65 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.306 -0.861 . . . . 73.439999999999998 112.456 -176.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -129.13 -46.27 1.23 Allowed 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.165 -0.614 . . . . 74.430000000000007 109.949 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.451 ' CE2' ' HA ' ' A' ' 65' ' ' MET . 16.3 p90 -72.42 -17.07 61.83 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.742 -0.383 . . . . 71.230000000000004 110.028 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.724 ' HA ' ' HD3' ' A' ' 72' ' ' ARG . 6.2 m-30 -58.21 -50.5 73.33 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.766 -0.457 . . . . 74.530000000000001 109.766 174.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.65 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.36 -47.11 79.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.669 0.747 . . . . 71.329999999999998 109.467 174.444 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -80.0 31.42 0.26 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.58 -1.191 . . . . 73.129999999999995 111.437 -176.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.724 ' HD3' ' HA ' ' A' ' 69' ' ' TYR . 4.8 mtp180 -103.19 -29.75 11.11 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.662 -0.649 . . . . 72.319999999999993 111.452 -176.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.914 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -115.95 14.65 16.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.325 -0.55 . . . . 74.239999999999995 111.493 -177.746 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -63.34 -50.83 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.457 -0.572 . . . . 74.230000000000004 109.457 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.9 -30.79 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.841 -0.618 . . . . 73.420000000000002 111.272 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.4 mtt -69.46 -41.25 76.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.235 0.54 . . . . 72.329999999999998 109.571 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tt -68.92 -31.78 70.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.99 -1.005 . . . . 74.409999999999997 109.095 -179.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.569 ' N ' ' HE1' ' B' ' 266' ' ' MET . 16.1 t70 -61.86 -34.4 75.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.112 -0.949 . . . . 73.230000000000004 110.912 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.05 -4.2 46.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 52.219999999999999 111.1 -178.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.23 -31.18 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.099 0.476 . . . . 74.400000000000006 109.85 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.584 ' HG3' ' SD ' ' B' ' 266' ' ' MET . 25.0 mmt -68.82 176.32 3.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.457 -0.792 . . . . 74.319999999999993 110.663 174.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.587 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 9.6 mm-40 65.29 -30.6 0.13 Allowed 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.331 1.053 . . . . 73.420000000000002 113.19 -177.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 81' ' ' MET . 22.7 t70 -57.76 -64.02 1.04 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.9 0.381 . . . . 73.319999999999993 110.851 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -68.15 -14.66 63.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.379 . . . . 71.319999999999993 110.953 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.587 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 63.3 mt -81.49 -57.71 4.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 65.420000000000002 111.025 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.5 pt-20 -58.48 -34.68 71.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.931 0.396 . . . . 72.230000000000004 110.428 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.427 ' N ' ' HG3' ' A' ' 86' ' ' GLU . 50.6 m-80 -88.11 -0.55 57.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.049 -0.523 . . . . 74.430000000000007 111.462 -177.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.472 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 83.9 t80 -61.34 -43.51 98.75 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 120.4 -0.52 . . . . 63.340000000000003 109.863 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.21 -31.66 71.43 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 64.219999999999999 110.238 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -69.98 -52.44 24.27 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.62 -0.718 . . . . 63.439999999999998 109.865 177.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -59.58 -47.36 85.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.209 0.528 . . . . 65.219999999999999 110.885 178.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -69.98 -11.06 60.6 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.534 -0.757 . . . . 74.150000000000006 110.559 -177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -91.76 -34.97 14.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.957 0.408 . . . . 62.229999999999997 110.461 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 33.1 p -72.95 -25.73 61.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.141 -0.481 . . . . 75.299999999999997 111.634 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -92.83 152.18 19.58 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.101 -0.333 . . . . 64.209999999999994 110.101 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 46.5 mtmt . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 116.248 -0.433 . . . . 65.019999999999996 111.092 -176.622 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.452 -0.358 0 CA-C-O 121.07 0.462 . . . . 75.200000000000003 110.177 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -124.63 157.8 34.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.838 -0.619 . . . . 62.43 109.551 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.544 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.2 p-10 -70.35 149.68 47.09 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.13 0.491 . . . . 72.540000000000006 111.114 -176.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -81.39 -90.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.805 -0.634 . . . . 72.420000000000002 111.365 -175.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -102.53 -36.83 8.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.285 0.564 . . . . 54.450000000000003 109.846 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.544 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -97.82 150.75 20.93 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.473 -0.785 . . . . 74.409999999999997 110.74 176.263 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.51 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -75.85 54.77 0.84 Allowed 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.659 -1.155 . . . . 63.350000000000001 112.121 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -52.8 -43.39 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.414 -0.357 . . . . 74.209999999999994 111.094 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -68.03 -10.77 56.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.824 -0.625 . . . . 70.549999999999997 112.086 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.561 ' HE ' ' HA ' ' B' ' 210' ' ' ARG . 1.1 mmp_? -96.13 -60.83 1.55 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.921 -0.4 . . . . 70.530000000000001 109.921 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.719 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.24 -20.6 28.4 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.807 0.669 . . . . 65.409999999999997 112.807 -176.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.26 -24.54 65.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.794 0.33 . . . . 71.230000000000004 111.038 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.475 ' HB2' HD11 ' A' ' 17' ' ' LEU . 41.8 mt-10 -87.34 -24.04 24.41 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.13 0.491 . . . . 75.319999999999993 109.962 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.719 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.8 mm? -68.88 -49.1 61.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.538 -0.755 . . . . 63.420000000000002 110.334 -178.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.572 HG13 ' HB1' ' A' ' 39' ' ' ALA . 65.2 mt -68.86 -25.23 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.01 0.433 . . . . 74.409999999999997 110.385 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.512 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.9 OUTLIER -59.0 -36.07 74.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.048 -0.524 . . . . 53.439999999999998 110.439 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.3 tm? -65.89 -43.55 87.95 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.096 -0.705 . . . . 74.030000000000001 109.096 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.09 66.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 74.439999999999998 110.678 178.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 12.6 m120 -62.09 -35.09 77.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.008 -0.542 . . . . 75.329999999999998 110.247 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -74.33 -24.96 59.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.195 -0.457 . . . . 65.400000000000006 111.216 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 221' ' ' GLN . . . . . 0.428 ' HB2' HG13 ' B' ' 232' ' ' VAL . 62.7 mt-30 -86.85 -27.43 23.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.994 0.426 . . . . 72.340000000000003 110.33 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -81.17 -1.88 46.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.859 -0.61 . . . . 71.519999999999996 110.744 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.8 mm-40 -69.96 -17.52 63.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.108 0.48 . . . . 74.219999999999999 110.388 176.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.425 ' HB3' HG13 ' B' ' 227' ' ' ILE . 0.9 OUTLIER -79.6 124.53 28.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.965 -0.561 . . . . 73.340000000000003 110.109 176.101 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.7 t -99.86 -17.32 17.69 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.09 -0.505 . . . . 71.409999999999997 110.232 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -80.64 -6.42 58.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 75.540000000000006 110.932 176.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.425 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.2 mt -111.96 153.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.467 -0.568 . . . . 74.030000000000001 109.467 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.19 142.21 49.05 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.064 -0.347 . . . . 45.539999999999999 110.064 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.1 m -62.22 -24.08 67.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.523 0.678 . . . . 75.430000000000007 109.981 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 230' ' ' GLY . . . . . 0.453 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.32 -32.16 83.28 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.383 -0.826 . . . . 25.0 112.676 178.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -65.09 -32.54 74.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.889 0.376 . . . . 75.430000000000007 110.673 -177.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 232' ' ' VAL . . . . . 0.428 HG13 ' HB2' ' B' ' 221' ' ' GLN . 11.8 t -75.09 -29.27 21.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 74.140000000000001 110.657 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 72.3 p -74.63 -24.96 58.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.437 0.637 . . . . 63.299999999999997 109.493 175.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.81 -33.91 34.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.446 -0.797 . . . . 64.219999999999999 110.906 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 5.3 p -67.61 -36.63 81.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 120.898 0.38 . . . . 65.140000000000001 110.071 177.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.589 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 2.1 t80 -68.39 -36.01 78.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 74.230000000000004 109.406 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.914 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.3 tpt -63.31 -56.41 16.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.251 -0.886 . . . . 62.25 110.527 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.3 t-105 -60.53 -35.61 76.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.206 -0.906 . . . . 72.200000000000003 111.103 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.42 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.99 -43.22 88.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.418 -0.355 . . . . 74.299999999999997 111.338 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.18 -34.81 78.45 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.733 0.301 . . . . 70.409999999999997 110.489 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.9 79.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 73.219999999999999 111.102 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 242' ' ' ARG . . . . . 0.422 HH21 HD12 ' A' ' 15' ' ' ILE . 28.6 mtm180 -70.45 -27.81 64.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 75.040000000000006 111.125 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.451 ' HD2' HG23 ' A' ' 15' ' ' ILE . 8.8 t80 -80.86 -34.86 33.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 72.299999999999997 110.349 -178.344 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -75.95 -35.82 59.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.029 -0.532 . . . . 71.099999999999994 110.852 -176.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.37 -22.69 63.59 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.967 -0.561 . . . . 73.340000000000003 111.798 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.5 t90 -55.19 -33.86 63.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.99 -0.55 . . . . 75.319999999999993 111.443 179.147 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -74.58 -7.46 53.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 75.340000000000003 111.975 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -65.14 -34.59 90.08 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.271 -0.966 . . . . 74.310000000000002 111.491 176.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.2 m -71.22 -9.69 58.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.76 0.314 . . . . 70.340000000000003 111.681 -177.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.4 t -119.74 16.77 12.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 74.530000000000001 110.388 178.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.6 t -90.22 -27.45 19.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.054 0.454 . . . . 72.0 109.941 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 252' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -146.06 170.41 16.71 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.222 -0.659 . . . . 73.420000000000002 109.222 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.553 ' HG3' HG23 ' B' ' 254' ' ' THR . 10.1 pt-20 -89.41 -37.38 14.87 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.787 -0.365 . . . . 64.530000000000001 111.557 -175.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.553 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.7 p -110.94 159.75 17.43 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 123.166 0.292 . . . . 63.009999999999998 110.535 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.614 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 12.0 ptmm? -74.79 -26.14 59.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.847 -0.427 . . . . 72.439999999999998 109.847 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -54.47 -42.7 70.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 72.430000000000007 110.619 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' B' ' 261' ' ' LYS . 86.3 mt-30 -91.48 -37.12 13.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.763 -0.653 . . . . 70.450000000000003 110.394 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.614 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 17.9 ttt -60.56 -40.85 93.14 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.078 -0.51 . . . . 63.409999999999997 111.712 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.472 ' HB2' HG21 ' A' ' 85' ' ' ILE . 31.5 tt0 -72.33 -31.17 65.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.067 -0.515 . . . . 73.310000000000002 111.844 -174.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -79.31 -13.42 59.66 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.266 0.555 . . . . 61.020000000000003 110.984 -167.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.577 ' HD3' ' C ' ' B' ' 261' ' ' LYS . 0.0 OUTLIER -126.78 26.37 6.22 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 115.67 -0.695 . . . . 74.530000000000001 112.138 -175.512 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.651 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 0.0 OUTLIER -59.17 -35.0 72.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.095 -0.502 . . . . 74.120000000000005 109.907 175.886 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.408 ' N ' ' HG2' ' B' ' 262' ' ' LYS . 5.2 tp-100 -73.09 -25.56 60.93 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.329 -0.396 . . . . 74.430000000000007 111.434 -176.31 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 264' ' ' GLU . . . . . 0.45 ' OE1' ' HB2' ' B' ' 261' ' ' LYS . 40.5 mt-10 -57.47 -55.16 38.37 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.219 0.533 . . . . 73.230000000000004 110.309 176.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.705 ' HA ' ' CE2' ' B' ' 268' ' ' TYR . 2.2 ptt? -72.33 -34.79 68.32 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.955 -0.566 . . . . 74.219999999999999 109.909 -177.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.584 ' SD ' ' HG3' ' A' ' 81' ' ' MET . 26.5 mtp -79.98 19.36 0.71 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.923 -0.581 . . . . 74.519999999999996 111.639 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.98 -44.06 3.06 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.574 -0.528 . . . . 73.329999999999998 109.574 175.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.705 ' CE2' ' HA ' ' B' ' 265' ' ' MET . 20.7 p90 -91.27 -19.41 23.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.016 -0.538 . . . . 73.530000000000001 111.561 -178.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.427 ' CE2' ' HB2' ' B' ' 265' ' ' MET . 1.6 m-30 -52.76 -48.17 66.96 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.825 0.345 . . . . 70.409999999999997 110.763 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.65 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -54.05 -47.97 71.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.598 -0.728 . . . . 53.329999999999998 111.217 178.353 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.66 26.88 2.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.376 -0.829 . . . . 72.209999999999994 111.765 -168.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 12.0 mtp180 -95.66 -26.86 15.56 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.485 -0.486 . . . . 64.319999999999993 111.626 -178.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.752 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.06 11.1 37.64 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.523 -0.471 . . . . 71.209999999999994 110.45 -178.841 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.431 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.6 ttmt -65.01 -43.35 92.79 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.119 -0.491 . . . . 71.209999999999994 110.403 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.43 -39.47 93.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.651 0.263 . . . . 45.350000000000001 111.418 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.5 mtt -61.31 -46.24 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.453 0.644 . . . . 70.310000000000002 109.727 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.444 ' CD2' ' HE2' ' B' ' 281' ' ' MET . 1.1 tt -67.58 -33.25 74.65 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.784 -1.098 . . . . 61.439999999999998 109.663 -178.51 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 278' ' ' ASP . . . . . 0.529 ' N ' ' HE1' ' A' ' 66' ' ' MET . 19.6 t70 -64.86 -28.38 69.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.253 -0.885 . . . . 74.430000000000007 110.425 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -90.33 -2.39 57.99 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.261 -0.881 . . . . 62.140000000000001 111.092 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -104.91 -23.76 12.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 72.109999999999999 110.507 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.444 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.3 mmt -69.31 179.18 2.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.537 0.684 . . . . 71.209999999999994 111.672 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.722 ' HA ' HD12 ' B' ' 285' ' ' ILE . 30.2 mt-10 68.63 -12.29 0.37 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.326 -1.306 . . . . 64.409999999999997 112.97 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.96 -58.93 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 72.209999999999994 110.395 177.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -72.65 -16.06 61.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.165 -0.471 . . . . 75.219999999999999 110.885 178.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.722 HD12 ' HA ' ' B' ' 282' ' ' GLU . 60.9 mt -77.54 -57.08 6.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.116 -0.493 . . . . 73.129999999999995 110.551 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.2 pt-20 -67.34 -25.26 65.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 52.240000000000002 110.809 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -94.99 15.75 17.99 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.179 -0.464 . . . . 74.200000000000003 111.519 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.499 ' O ' ' HB2' ' B' ' 292' ' ' ARG . 20.2 t80 -58.12 -50.09 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.198 -0.667 . . . . 75.129999999999995 109.198 173.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -57.95 -28.24 64.13 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.667 -0.697 . . . . 71.420000000000002 111.33 175.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -74.88 -55.62 5.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.065 -0.516 . . . . 73.430000000000007 110.323 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -69.5 -38.93 77.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.246 -0.434 . . . . 64.310000000000002 111.349 -177.012 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' B' ' 288' ' ' PHE . 0.6 OUTLIER -65.65 -20.0 66.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.087 0.47 . . . . 74.319999999999993 109.895 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -85.53 -27.5 25.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.044 -0.525 . . . . 71.530000000000001 110.904 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.3 p -82.99 -8.71 59.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 73.439999999999998 111.186 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -116.51 160.1 21.11 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.207 -0.451 . . . . 71.310000000000002 110.356 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.293 -0.861 . . . . 62.030000000000001 109.626 -179.052 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 110.255 -0.276 . . . . 72.019999999999996 110.255 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -99.92 -86.47 0.38 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.616 0.245 . . . . 61.399999999999999 110.788 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.753 ' ND2' ' HA ' ' A' ' 7' ' ' PHE . 89.1 m-20 -127.52 170.3 12.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.116 0.484 . . . . 75.439999999999998 111.208 -176.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -97.31 -80.58 0.44 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.4 -0.963 . . . . 71.140000000000001 108.4 168.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -113.6 -47.63 2.98 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.897 -0.779 . . . . 72.450000000000003 108.897 170.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -82.82 159.49 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.408 -0.815 . . . . 64.319999999999993 111.835 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.753 ' HA ' ' ND2' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -75.82 56.36 0.94 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.87 -1.059 . . . . 65.099999999999994 112.309 179.272 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.451 ' HE1' ' HZ2' ' B' ' 238' ' ' TRP . 58.5 m-85 -56.2 -44.35 79.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.514 -0.312 . . . . 73.420000000000002 111.419 -179.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.61 61.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.339 -0.391 . . . . 70.329999999999998 111.627 -177.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -88.18 -65.23 1.04 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.397 -0.365 . . . . 72.120000000000005 110.099 177.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.693 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -58.64 -21.94 55.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 112.68 0.622 . . . . 72.010000000000005 112.68 -175.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.642 HG23 ' HG2' ' A' ' 13' ' ' GLU . 6.1 t -59.41 -28.91 67.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.136 0.494 . . . . 71.209999999999994 110.814 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.642 ' HG2' HG23 ' A' ' 12' ' ' THR . 5.4 mm-40 -92.31 -26.3 18.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.874 -0.603 . . . . 71.430000000000007 110.171 -173.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.693 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -64.51 -45.03 89.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.298 -0.864 . . . . 62.530000000000001 109.178 173.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.519 HG13 ' HB1' ' B' ' 239' ' ' ALA . 89.4 mt -69.24 -34.76 64.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.689 -0.687 . . . . 73.109999999999999 110.373 175.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -64.22 -30.83 71.87 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.849 -0.614 . . . . 64.019999999999996 111.351 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.59 HD12 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -65.04 -41.85 94.85 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.946 -0.761 . . . . 70.310000000000002 108.946 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.94 70.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.378 -0.828 . . . . 74.540000000000006 110.865 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -63.47 -26.36 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.817 -0.628 . . . . 64.209999999999994 110.978 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.417 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 2.7 mp0 -85.35 -8.61 58.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.207 -0.451 . . . . 75.430000000000007 111.194 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . 0.428 ' OE1' HD21 ' B' ' 214' ' ' LEU . 80.8 mt-30 -104.68 -29.27 10.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.82 0.343 . . . . 74.150000000000006 110.498 177.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -83.08 -12.47 57.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.037 0.446 . . . . 73.439999999999998 110.569 179.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.417 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.9 pt20 -73.45 -1.01 16.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.175 0.512 . . . . 70.5 110.326 175.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.607 ' HB3' HG13 ' A' ' 27' ' ' ILE . 0.8 OUTLIER -82.43 108.02 15.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.832 -0.803 . . . . 52.240000000000002 108.832 175.665 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.4 t -62.03 -25.61 67.76 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 113.028 0.751 . . . . 62.119999999999997 113.028 -171.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.3 0.88 55.64 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.986 0.365 . . . . 72.420000000000002 111.986 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.607 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.1 mt -113.31 147.78 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.476 -0.564 . . . . 71.400000000000006 109.476 176.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -88.5 157.95 18.48 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.837 -0.431 . . . . 71.129999999999995 109.837 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.4 m -65.73 -27.54 68.39 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.107 0.48 . . . . 54.420000000000002 110.012 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.19 -29.94 76.4 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.63 -0.714 . . . . 73.510000000000005 112.669 178.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -69.96 -30.98 68.47 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.468 0.651 . . . . 72.109999999999999 109.612 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.7 t -82.1 -32.89 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.189 -0.914 . . . . 54.420000000000002 110.771 -177.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.402 ' HB3' ' CE1' ' B' ' 247' ' ' PHE . 93.2 p -65.92 -28.77 69.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.315 0.579 . . . . 65.109999999999999 109.803 176.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.0 -32.44 26.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.608 -0.724 . . . . 65.409999999999997 111.216 -178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.437 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 15.1 p -70.51 -36.79 73.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.971 0.415 . . . . 71.549999999999997 109.968 -178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.709 ' HD1' HD12 ' B' ' 214' ' ' LEU . 17.2 t80 -64.93 -35.29 80.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.402 0.62 . . . . 74.310000000000002 109.713 175.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.61 ' CG ' ' HB3' ' B' ' 273' ' ' TYR . 13.2 ttm -73.27 -47.44 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.657 -0.701 . . . . 74.319999999999993 111.529 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 14.9 t-105 -60.03 -36.63 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.919 0.39 . . . . 74.310000000000002 110.352 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.49 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.64 -38.09 88.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 73.510000000000005 110.862 177.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.0 tp -66.35 -38.48 87.71 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 110.012 -0.366 . . . . 51.020000000000003 110.012 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.473 ' HB2' ' HB2' ' B' ' 273' ' ' TYR . . . -60.74 -28.23 68.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.34 -0.391 . . . . 74.439999999999998 111.155 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -86.12 -45.44 11.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.037 0.446 . . . . 73.329999999999998 110.665 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.46 ' HD2' HG23 ' B' ' 215' ' ' ILE . 24.5 t80 -70.22 -37.16 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.898 -0.592 . . . . 65.400000000000006 111.205 -175.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.7 -18.6 58.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.289 -0.414 . . . . 74.319999999999993 111.184 -174.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.565 ' HB2' HD23 ' B' ' 277' ' ' LEU . . . -78.68 -5.15 52.3 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.109 0.48 . . . . 71.420000000000002 110.968 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -57.41 -39.51 76.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.420000000000002 109.913 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.424 ' HA ' HG22 ' A' ' 50' ' ' THR . 92.8 m-85 -75.91 -9.08 58.31 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.903 -0.59 . . . . 62.149999999999999 111.38 -176.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.504 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.13 -38.32 92.14 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.624 -0.99 . . . . 55.310000000000002 110.624 172.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.7 m -71.74 -6.81 44.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.494 0.318 . . . . 74.310000000000002 111.581 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.424 HG22 ' HA ' ' A' ' 47' ' ' PHE . 6.1 t -117.44 10.98 13.75 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.209 0.528 . . . . 74.319999999999993 110.113 178.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.73 -44.24 15.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.954 -0.566 . . . . 53.310000000000002 110.236 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.562 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.1 m-85 -145.29 176.35 9.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.426 -0.352 . . . . 61.399999999999999 111.081 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.4 ' HG2' ' H ' ' A' ' 53' ' ' GLU . 7.9 pt-20 -97.77 -42.29 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.712 -0.676 . . . . 62.219999999999999 111.636 -173.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 63.8 p -102.57 152.41 21.19 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.746 -0.207 . . . . 65.340000000000003 110.509 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -65.85 -32.19 73.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.083 0.468 . . . . 71.439999999999998 110.17 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -52.62 -51.32 60.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.043 -0.981 . . . . 63.020000000000003 110.606 178.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.628 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 95.5 mt-30 -87.65 -32.92 19.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.525 -0.761 . . . . 61.149999999999999 111.064 -176.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 18.5 ttt -64.21 -42.43 96.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.894 0.378 . . . . 64.340000000000003 110.786 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.55 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 36.7 tt0 -65.67 -27.7 68.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 75.209999999999994 110.679 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.99 -8.45 57.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.358 -0.383 . . . . 71.109999999999999 110.778 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.628 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 29.4 mmmt -114.87 -6.62 12.62 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.35 -0.386 . . . . 71.209999999999994 111.319 -176.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.703 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 56.5 pttt -65.23 -44.7 87.36 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.614 -0.435 . . . . 65.120000000000005 110.956 -172.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.42 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 9.1 tp60 -74.96 -16.99 60.62 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.921 -0.4 . . . . 73.140000000000001 109.921 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -78.82 -38.59 37.76 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.375 -0.375 . . . . 72.129999999999995 110.765 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.703 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 18.4 ptp -80.65 -27.92 37.02 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.633 -0.877 . . . . 71.349999999999994 108.633 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.423 ' CE ' ' HB3' ' B' ' 277' ' ' LEU . 45.5 mtp -90.45 9.6 28.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.994 -1.003 . . . . 64.299999999999997 111.248 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -81.36 -37.15 28.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.401 -0.592 . . . . 74.120000000000005 109.401 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.527 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 48.3 p90 -106.83 -10.1 16.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.607 -0.724 . . . . 63.340000000000003 111.327 -175.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.431 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 2.3 m-30 -55.55 -51.35 67.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.714 0.292 . . . . 74.329999999999998 110.992 -178.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.886 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.83 -41.27 77.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.704 0.764 . . . . 74.329999999999998 110.008 175.854 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -80.71 3.74 21.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.417 -1.265 . . . . 73.239999999999995 112.443 -169.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.692 ' HB2' ' SD ' ' B' ' 237' ' ' MET . 48.0 mtm180 -82.76 -41.53 19.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 121.653 -0.654 . . . . 73.329999999999998 110.621 -173.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.832 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -94.12 9.83 36.21 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.285 0.564 . . . . 64.109999999999999 109.924 -176.08 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.222 -0.899 . . . . 64.010000000000005 110.003 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -68.93 -30.26 68.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 75.5 110.844 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.411 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 57.1 mtt -68.26 -38.54 81.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.378 0.609 . . . . 75.5 110.064 176.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.598 ' HB3' ' HE3' ' B' ' 266' ' ' MET . 0.5 OUTLIER -72.14 -44.85 62.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.125 -0.943 . . . . 73.510000000000005 110.63 -176.531 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.63 -41.21 80.92 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.314 0.578 . . . . 61.219999999999999 110.213 -178.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.87 -20.12 65.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.078 -0.965 . . . . 71.299999999999997 111.753 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.682 ' OD1' ' HD2' ' B' ' 242' ' ' ARG . 0.8 OUTLIER -92.83 -30.35 15.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.781 0.324 . . . . 72.340000000000003 110.868 179.721 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.593 ' HE2' ' HA ' ' B' ' 245' ' ' ALA . 21.6 mmt -61.89 -61.96 2.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.776 -0.647 . . . . 74.340000000000003 111.226 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.58 ' HA ' HD12 ' A' ' 85' ' ' ILE . 7.4 pt-20 -70.22 -13.08 62.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.721 -0.672 . . . . 72.430000000000007 112.771 -171.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.1 -51.96 66.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.374 . . . . 64.319999999999993 110.303 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -64.95 -36.51 84.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.128 0.49 . . . . 73.329999999999998 110.0 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.888 HD13 ' HA ' ' B' ' 259' ' ' GLN . 79.3 mt -63.69 -57.16 12.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.382 -0.826 . . . . 72.519999999999996 112.136 -176.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.8 pt-20 -61.72 -32.48 72.71 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.037 -0.265 . . . . 63.450000000000003 111.084 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -93.2 5.24 52.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.342 -0.39 . . . . 65.150000000000006 111.592 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.541 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 63.7 t80 -57.36 -49.88 74.74 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 121.481 -0.088 . . . . 72.0 111.225 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.445 ' OD2' ' HD3' ' B' ' 255' ' ' LYS . 72.1 m-20 -58.47 -31.41 67.8 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.985 0.421 . . . . 73.209999999999994 110.45 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -71.11 -55.61 7.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.917 -0.583 . . . . 74.439999999999998 110.435 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.487 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 30.9 m-85 -63.37 -42.39 98.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.893 0.377 . . . . 75.25 111.202 -179.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ARG . . . . . 0.477 ' HD2' ' O ' ' A' ' 92' ' ' ARG . 7.5 tmm_? -67.71 -19.58 65.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.037 -0.528 . . . . 75.510000000000005 110.227 -177.698 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -82.21 -34.15 29.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.431 -0.35 . . . . 72.209999999999994 110.819 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 5.0 p -75.77 -18.81 59.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.032 0.444 . . . . 72.430000000000007 110.628 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.487 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 78.0 mt-30 -77.65 127.42 32.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.815 -0.63 . . . . 75.420000000000002 109.4 173.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt . . . . . 0 C--N 1.318 -0.769 0 CA-C-N 116.236 -0.438 . . . . 70.409999999999997 110.732 -175.209 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 21.3 m . . . . . 0 CA--C 1.531 0.216 0 CA-C-O 120.809 0.338 . . . . 73.209999999999994 111.041 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -135.64 -79.74 0.42 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.414 -0.357 . . . . 63.229999999999997 110.335 178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.769 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 94.7 m-20 -134.19 179.17 6.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.124 -0.489 . . . . 75.120000000000005 110.281 -179.385 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 204' ' ' GLU . . . . . 0.447 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 13.6 tp10 -132.43 -77.37 0.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.092 -0.504 . . . . 75.340000000000003 110.239 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -98.92 -21.74 16.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.402 0.62 . . . . 74.549999999999997 109.769 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.469 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -148.72 168.66 22.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.565 -0.743 . . . . 74.540000000000006 112.043 -174.082 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.769 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -70.87 53.81 0.16 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.488 -1.233 . . . . 73.239999999999995 112.429 178.295 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.447 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 29.3 m-85 -56.24 -47.4 78.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.611 -0.268 . . . . 72.430000000000007 111.136 -178.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.94 -16.05 63.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 63.0 111.735 -176.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.681 ' HE ' ' HA ' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -88.12 -63.59 1.28 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.44 -0.345 . . . . 53.119999999999997 110.16 177.673 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.624 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -53.67 -29.65 39.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.905 0.705 . . . . 72.120000000000005 112.905 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 212' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 7.1 t -64.68 -25.01 67.76 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.675 0.274 . . . . 45.100000000000001 111.073 -177.132 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -82.3 -24.3 34.73 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.251 0.548 . . . . 73.209999999999994 109.622 -178.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.709 HD12 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -68.9 -42.63 76.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.347 -0.842 . . . . 70.510000000000005 109.279 177.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.49 HG13 ' HB1' ' A' ' 39' ' ' ALA . 87.8 mt -68.91 -28.48 39.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.423 -0.808 . . . . 72.120000000000005 110.255 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' B' ' 212' ' ' THR . 28.4 mmmt -57.27 -47.26 81.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.349 -0.387 . . . . 64.230000000000004 111.503 178.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.509 HD13 ' O ' ' B' ' 217' ' ' LEU . 1.9 tm? -61.59 -32.17 72.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.5 -0.556 . . . . 74.120000000000005 109.5 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -68.8 -32.98 73.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.819 -0.628 . . . . 54.539999999999999 110.821 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -66.56 -31.05 71.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.877 0.37 . . . . 71.219999999999999 110.783 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.66 -4.81 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.08 -0.509 . . . . 64.109999999999999 111.175 -178.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -110.17 -17.86 13.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.529 0.68 . . . . 72.439999999999998 109.295 172.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -78.96 -21.54 47.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.871 -1.058 . . . . 75.420000000000002 110.196 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.17 12.37 0.74 Allowed 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.671 -0.695 . . . . 73.340000000000003 111.975 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.501 ' HB3' HG13 ' B' ' 227' ' ' ILE . 0.7 OUTLIER -98.31 109.35 22.12 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 44.32 109.72 179.599 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 225' ' ' THR . . . . . 0.4 ' H ' HG22 ' B' ' 225' ' ' THR . 2.7 t -65.46 -28.89 69.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.488 0.551 . . . . 61.439999999999998 112.488 -173.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -87.91 4.58 44.23 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.915 0.339 . . . . 61.200000000000003 111.915 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.501 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.1 mt -117.86 161.66 16.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.149 -0.686 . . . . 52.219999999999999 109.149 174.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 9.5 mp0 -105.29 152.23 23.16 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.477 -0.564 . . . . 74.530000000000001 109.477 178.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.0 m -55.83 -28.28 55.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.03 0.443 . . . . 72.150000000000006 110.687 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -64.11 -22.67 67.18 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.705 -0.679 . . . . 75.430000000000007 113.22 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -83.84 -17.13 41.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.232 0.539 . . . . 50.310000000000002 110.018 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 15.2 t -90.2 -39.52 12.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 72.420000000000002 109.854 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 33.5 p -65.8 -34.36 77.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.21 0.529 . . . . 63.340000000000003 109.841 175.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -72.03 -34.33 68.72 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.571 -0.741 . . . . 33.240000000000002 111.325 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.467 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 4.0 p -75.82 -32.64 59.92 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.986 -0.376 . . . . 34.329999999999998 109.986 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.47 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.9 t80 -64.96 -39.73 93.94 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.001 -0.74 . . . . 74.239999999999995 109.001 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.832 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 1.2 ttm -66.65 -48.3 69.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.395 -0.82 . . . . 62.140000000000001 111.226 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.451 ' HZ2' ' HE1' ' A' ' 8' ' ' TYR . 19.2 t-105 -60.62 -44.46 96.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.395 -0.366 . . . . 72.019999999999996 110.758 177.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.533 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -61.95 -36.26 80.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.412 . . . . 74.420000000000002 111.057 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.52 -40.56 97.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.378 -0.374 . . . . 71.099999999999994 110.278 177.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.584 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.77 -45.1 94.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.065 0.46 . . . . 72.450000000000003 110.344 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 242' ' ' ARG . . . . . 0.682 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 11.1 mmm180 -58.87 -41.28 86.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 63.310000000000002 110.755 178.095 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 243' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' B' ' 246' ' ' TRP . 10.5 t80 -75.92 -38.22 57.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 64.040000000000006 111.028 -175.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -69.55 -31.78 70.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.887 0.328 . . . . 64.409999999999997 111.887 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.593 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -72.32 -17.64 61.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 65.030000000000001 111.266 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 246' ' ' TRP . . . . . 0.404 ' HB3' ' O ' ' B' ' 243' ' ' TYR . 12.6 t90 -64.64 -23.69 67.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.614 -0.721 . . . . 74.200000000000003 109.68 175.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 0.429 ' O ' HG22 ' B' ' 250' ' ' THR . 69.1 m-85 -85.47 2.89 42.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.095 -0.502 . . . . 74.239999999999995 111.39 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.87 92.44 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.237 -0.982 . . . . 61.509999999999998 111.445 175.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.0 m -62.33 -24.57 67.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.681 0.277 . . . . 71.540000000000006 111.658 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 250' ' ' THR . . . . . 0.429 HG22 ' O ' ' B' ' 247' ' ' PHE . 14.6 t -98.27 10.7 40.05 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.606 -0.438 . . . . 44.140000000000001 110.738 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 33.7 t -87.93 -54.58 4.16 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.966 -0.383 . . . . 61.219999999999999 109.966 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.643 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 2.0 m-85 -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.165 0.507 . . . . 72.540000000000006 111.736 178.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.54 ' HG3' HG23 ' B' ' 254' ' ' THR . 8.9 pt-20 -95.45 -47.22 6.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.12 -0.946 . . . . 71.310000000000002 111.628 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.54 HG23 ' HG3' ' B' ' 253' ' ' GLU . 65.2 p -102.67 161.85 13.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.572 -0.285 . . . . 71.420000000000002 110.501 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.8 ptmt -72.38 -29.8 64.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.877 -0.329 . . . . 73.400000000000006 110.503 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -61.05 -41.7 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.938 -0.574 . . . . 50.329999999999998 110.574 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.616 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 97.3 mt-30 -86.81 -39.75 15.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.922 -0.581 . . . . 74.519999999999996 110.809 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.3 ttt -63.81 -35.8 81.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.404 -0.362 . . . . 73.109999999999999 111.194 -178.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.888 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.9 tt0 -62.52 -40.85 98.08 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.934 0.397 . . . . 74.230000000000004 111.073 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -71.35 -9.12 57.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.836 -0.62 . . . . 64.140000000000001 111.183 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.643 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 31.5 mmmt -107.99 -3.44 18.79 Favored 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 111.947 0.351 . . . . 53.210000000000001 111.947 -173.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 262' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 50.9 pttt -59.51 -49.73 76.65 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.217 -0.593 . . . . 74.319999999999993 110.401 -177.133 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 263' ' ' GLN . . . . . 0.504 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 17.8 tp60 -67.46 -23.19 65.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.873 0.368 . . . . 60.32 110.568 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -82.45 -34.24 28.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.192 -0.458 . . . . 73.439999999999998 111.535 -178.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 21.6 ptp -83.88 -25.34 30.31 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.883 -0.784 . . . . 71.420000000000002 108.883 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.598 ' HE3' ' HB3' ' A' ' 77' ' ' LEU . 56.1 mtp -85.83 -12.33 51.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.096 -0.956 . . . . 74.209999999999994 110.664 177.351 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -54.02 -41.35 67.92 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.099 -0.5 . . . . 53.210000000000001 111.087 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.573 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 17.9 p90 -105.89 -6.11 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.667 -0.697 . . . . 72.430000000000007 110.601 -175.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.486 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 1.4 m-30 -59.3 -54.06 51.13 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.641 -0.254 . . . . 75.400000000000006 110.477 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.886 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.98 -47.88 61.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.305 0.574 . . . . 65.010000000000005 110.207 174.492 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -86.05 23.68 1.46 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.113 -0.949 . . . . 71.150000000000006 112.272 -169.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 36.2 mtm180 -95.24 -28.84 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.382 -0.824 . . . . 71.150000000000006 111.576 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.61 ' HB3' ' CG ' ' A' ' 37' ' ' MET . 0.1 OUTLIER -112.2 13.04 20.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.175 0.512 . . . . 65.129999999999995 110.195 -178.689 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 274' ' ' LYS . . . . . 0.479 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 81.8 tttt -64.34 -51.98 60.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.648 -0.705 . . . . 72.530000000000001 110.843 -176.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.5 -30.75 68.68 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.926 0.393 . . . . 73.239999999999995 110.676 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.0 -39.77 93.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.759 -0.655 . . . . 54.109999999999999 110.13 177.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.565 HD23 ' HB2' ' A' ' 45' ' ' ALA . 0.5 OUTLIER -67.99 -40.03 83.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.481 -0.782 . . . . 64.209999999999994 110.57 -176.45 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.06 -34.87 78.51 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.025 0.44 . . . . 64.230000000000004 110.68 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.63 65.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 44.329999999999998 110.886 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -91.42 -29.28 17.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 74.439999999999998 110.124 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.577 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.9 mmt -61.54 -60.21 4.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 75.329999999999998 109.78 173.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.702 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 72.8 mm-40 -57.23 -22.6 42.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.595 -0.729 . . . . 71.510000000000005 111.926 -177.053 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -47.83 -50.37 26.33 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.436 0.46 . . . . 43.039999999999999 110.867 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -100.15 -10.61 21.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.369 -0.378 . . . . 75.200000000000003 111.729 178.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.702 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 68.1 mt -74.25 -55.25 12.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.726 -0.39 . . . . 65.430000000000007 110.503 177.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.665 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.1 pt-20 -66.18 -34.74 78.72 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.678 -0.409 . . . . 70.010000000000005 110.524 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.11 8.37 33.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.357 -0.383 . . . . 21.43 111.361 -178.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.85 -56.14 24.11 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.064 -0.347 . . . . 75.409999999999997 110.064 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -74.58 6.07 4.18 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.213 -0.449 . . . . 73.329999999999998 111.527 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -95.08 -55.4 3.09 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.753 -0.832 . . . . 74.200000000000003 108.753 172.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -65.68 -41.83 91.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.248 0.547 . . . . 72.430000000000007 110.22 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 292' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' B' ' 292' ' ' ARG . 3.0 tmm_? -71.21 -13.9 62.07 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.55 -0.75 . . . . 74.140000000000001 110.23 -178.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -90.98 -25.51 19.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.28 -0.418 . . . . 35.420000000000002 110.819 177.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 23.2 p -83.36 -9.19 59.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.102 0.477 . . . . 64.409999999999997 110.517 177.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -100.72 157.55 16.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.871 -0.604 . . . . 72.310000000000002 109.489 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 296' ' ' LYS . . . . . 0.478 ' HB2' ' HE3' ' B' ' 296' ' ' LYS . 30.4 mtmt . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.227 -0.892 . . . . 74.129999999999995 109.843 -175.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 121.129 0.49 . . . . 73.430000000000007 110.3 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -96.06 1.23 52.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.795 -0.639 . . . . 74.319999999999993 110.356 -177.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -149.56 169.4 21.02 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.964 -0.562 . . . . 73.230000000000004 110.598 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -90.54 -71.84 0.6 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.206 -0.665 . . . . 55.140000000000001 109.206 172.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -129.67 -46.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 62.039999999999999 110.049 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.89 164.45 22.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.937 -0.574 . . . . 42.25 111.599 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.543 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.4 OUTLIER -80.36 43.17 0.62 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.572 -0.74 . . . . 73.329999999999998 112.009 -175.589 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -44.49 -58.81 2.76 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.103 0.409 . . . . 74.420000000000002 112.103 -173.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.6 -21.64 53.98 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.171 0.804 . . . . 40.109999999999999 113.171 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -75.94 -49.22 18.38 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.338 -0.226 . . . . 72.219999999999999 111.032 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.69 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -71.01 -17.48 62.63 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.729 0.776 . . . . 73.439999999999998 109.933 -174.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.4 m -57.26 -37.41 72.31 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 114.453 -1.249 . . . . 64.230000000000004 111.292 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HB2' HD11 ' B' ' 217' ' ' LEU . 27.3 mt-10 -81.27 -21.13 39.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 73.329999999999998 110.276 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -69.1 -41.99 76.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 73.349999999999994 109.402 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.491 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.0 mt -74.07 -23.48 18.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.963 -0.562 . . . . 60.340000000000003 110.238 175.358 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 21.2 mmmt -58.67 -41.3 85.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 70.430000000000007 111.335 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.6 tm? -66.8 -31.38 71.97 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.266 -0.642 . . . . 45.119999999999997 109.266 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 -33.23 72.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.43 -0.805 . . . . 71.430000000000007 110.231 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.657 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 95.1 m-20 -61.39 -42.41 98.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.652 -0.704 . . . . 52.520000000000003 110.494 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.44 -27.38 67.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.947 -0.569 . . . . 75.140000000000001 111.461 -177.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -82.65 -30.13 29.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.276 0.56 . . . . 64.329999999999998 109.916 176.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -73.8 -20.07 60.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.501 -0.772 . . . . 51.310000000000002 110.356 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 89.7 mt-30 -64.2 -16.48 62.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.103 -0.498 . . . . 70.409999999999997 111.059 179.105 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -71.88 104.64 3.54 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.556 -0.535 . . . . 70.129999999999995 109.556 177.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -65.68 -34.53 78.43 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.46 -0.791 . . . . 60.020000000000003 111.912 -174.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -78.7 -5.78 54.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.325 0.491 . . . . 52.310000000000002 112.325 -176.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.2 mt -106.05 152.14 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.057 0.456 . . . . 63.240000000000002 110.222 179.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -79.35 155.96 28.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.76 -0.655 . . . . 74.340000000000003 109.68 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.1 m -69.84 -23.97 63.38 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.116 0.484 . . . . 72.109999999999999 110.431 -177.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.44 -14.62 74.72 Favored Glycine 0 C--N 1.333 0.396 0 CA-C-N 115.762 -0.654 . . . . 73.319999999999993 113.587 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -71.75 -37.92 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.416 0.608 . . . . 74.5 110.482 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 20.4 t -73.32 -43.03 57.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.598 -0.728 . . . . 74.150000000000006 110.695 -176.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.3 p -62.09 -44.11 97.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.085 0.469 . . . . 74.430000000000007 110.841 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.2 -32.92 74.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.812 -0.631 . . . . 60.450000000000003 111.14 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.7 m -65.89 -38.96 90.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.878 -0.416 . . . . 71.519999999999996 109.878 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . 0.717 ' HB3' HD13 ' B' ' 240' ' ' LEU . 1.2 t80 -67.12 -36.8 82.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.871 -0.604 . . . . 74.340000000000003 109.747 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.608 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.0 tpt -59.47 -53.76 54.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.157 -0.929 . . . . 54.549999999999997 110.473 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TRP . . . . . 0.469 ' NE1' ' HD2' ' A' ' 42' ' ' ARG . 18.1 t-105 -67.7 -38.7 84.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.943 -0.571 . . . . 75.439999999999998 111.42 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.47 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -62.4 -39.13 92.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.535 -0.302 . . . . 71.540000000000006 111.675 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.474 HD13 ' HB3' ' B' ' 236' ' ' PHE . 47.0 tp -65.44 -31.29 72.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.849 0.357 . . . . 75.530000000000001 110.574 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.18 90.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.248 -0.433 . . . . 74.450000000000003 110.918 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.469 ' HD2' ' NE1' ' A' ' 38' ' ' TRP . 28.8 mtp180 -68.84 -34.0 74.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 65.340000000000003 110.317 -177.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.434 ' HD2' HG23 ' B' ' 215' ' ' ILE . 6.0 t80 -76.64 -32.84 58.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.81 -0.632 . . . . 73.530000000000001 110.896 -175.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -79.21 -33.59 43.68 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.7 -0.227 . . . . 72.140000000000001 111.439 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.32 -17.93 64.97 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.189 0.518 . . . . 63.210000000000001 110.927 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -57.39 -32.32 66.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.193 -0.912 . . . . 74.319999999999993 111.062 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -85.05 1.68 46.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 61.130000000000003 111.969 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.59 -38.06 90.47 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.445 -0.883 . . . . 63.5 111.898 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.0 p -70.23 -17.9 63.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.85 0.357 . . . . 74.349999999999994 111.528 -177.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.2 p -92.44 -7.18 48.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 65.430000000000007 110.772 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -75.63 -35.96 60.35 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.229 -0.441 . . . . 52.350000000000001 111.677 -173.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.754 ' HE2' ' HG2' ' A' ' 61' ' ' LYS . 1.0 OUTLIER -147.27 175.67 10.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.329 0.585 . . . . 73.109999999999999 112.349 -175.8 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.629 ' HG3' HG23 ' A' ' 54' ' ' THR . 16.3 pt-20 -89.24 -37.08 15.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.08 -0.964 . . . . 73.030000000000001 111.546 -174.251 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.629 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.4 p -118.78 157.69 27.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 75.319999999999993 110.526 -177.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.475 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 21.2 ptmt -66.53 -29.95 70.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 73.540000000000006 110.503 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.34 -49.99 75.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.872 -0.604 . . . . 74.239999999999995 110.384 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.678 ' O ' ' HD3' ' A' ' 61' ' ' LYS . 96.6 mt-30 -78.08 -35.36 49.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.697 -0.683 . . . . 64.099999999999994 110.411 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 ttt -61.94 -41.29 97.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.049 0.452 . . . . 74.540000000000006 110.816 178.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.59 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.1 tt0 -65.47 -45.3 84.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.771 -0.65 . . . . 61.329999999999998 111.848 -176.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.36 -24.54 64.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.0 0.428 . . . . 64.329999999999998 111.355 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.754 ' HG2' ' HE2' ' A' ' 52' ' ' PHE . 3.9 mptp? -93.47 8.47 40.5 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 116.033 -0.531 . . . . 75.030000000000001 111.347 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.565 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 17.6 ptpt -51.7 -48.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.507 -0.553 . . . . 61.329999999999998 109.507 177.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.565 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 12.8 tp60 -72.22 -26.03 61.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.103 -0.498 . . . . 72.209999999999994 110.712 -176.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -81.84 -32.8 31.01 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 54.240000000000002 111.495 -176.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.8 ptp -83.36 -26.4 30.53 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 109.051 -0.722 . . . . 44.140000000000001 109.051 178.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.596 ' HG2' HD22 ' B' ' 277' ' ' LEU . 79.4 mtp -83.86 -4.68 58.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.16 -0.927 . . . . 64.299999999999997 111.756 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.59 -29.28 64.53 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.781 -0.822 . . . . 73.109999999999999 108.781 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 28.6 m-85 -99.93 -5.99 27.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.653 -1.158 . . . . 75.400000000000006 111.441 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.508 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 19.1 m-30 -77.3 -54.05 6.94 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.685 -1.228 . . . . 64.239999999999995 107.685 169.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.498 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -60.08 -66.27 0.55 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.308 -0.406 . . . . 71.540000000000006 110.21 171.313 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 10.6 t70 -95.44 82.62 3.7 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.437 0.532 . . . . 72.420000000000002 112.437 -171.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 8.8 mmm180 -153.15 -37.01 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.278 -0.419 . . . . 73.310000000000002 111.53 166.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.817 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -84.74 2.51 41.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 119.804 -0.758 . . . . 72.109999999999999 109.019 178.79 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.431 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 85.1 tttt -60.65 -50.55 73.05 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.039 -0.982 . . . . 65.099999999999994 110.079 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -37.19 85.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.255 -0.43 . . . . 75.049999999999997 111.113 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.5 mtt -63.01 -41.44 99.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.416 0.627 . . . . 74.400000000000006 109.919 177.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 1.3 tt -67.16 -43.06 83.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.815 -1.084 . . . . 73.010000000000005 109.86 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.84 -41.17 86.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.279 -0.873 . . . . 65.129999999999995 110.672 178.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.67 -10.36 59.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.413 -0.812 . . . . 70.239999999999995 111.987 -176.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.46 -3.17 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.783 -0.367 . . . . 72.5 111.463 -179.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . 0.437 ' HE3' ' CD2' ' A' ' 77' ' ' LEU . 23.8 mtt -88.16 -177.77 5.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.287 0.565 . . . . 61.340000000000003 111.752 177.252 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.772 ' HG2' HD12 ' A' ' 85' ' ' ILE . 34.1 mt-10 66.77 -3.75 0.87 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.634 -1.166 . . . . 71.030000000000001 112.879 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -56.45 -39.39 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.129 0.49 . . . . 71.310000000000002 110.405 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -92.71 -16.14 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.971 -0.559 . . . . 74.25 110.514 178.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.772 HD12 ' HG2' ' A' ' 82' ' ' GLU . 62.0 mt -79.1 -55.58 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 65.219999999999999 110.808 -175.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.609 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.0 pt-20 -64.64 -31.19 72.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.124 0.488 . . . . 55.539999999999999 110.268 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -89.12 7.72 33.66 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.827 -0.624 . . . . 52.549999999999997 111.382 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.412 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 70.0 t80 -62.24 -40.81 97.39 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.072 -0.344 . . . . 75.540000000000006 110.072 178.553 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -57.26 -41.73 80.19 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.402 -0.592 . . . . 61.039999999999999 109.402 176.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -65.31 -54.33 30.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.142 -0.935 . . . . 72.010000000000005 110.748 177.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.568 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 53.9 m-85 -61.24 -49.43 77.12 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.098 0.407 . . . . 73.030000000000001 112.098 -178.342 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -60.46 -19.85 57.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.25 0.548 . . . . 63.409999999999997 111.103 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -97.25 -29.36 13.6 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.171 -0.468 . . . . 74.030000000000001 111.156 -178.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 17.4 p -87.53 -4.9 58.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.09 -0.504 . . . . 74.519999999999996 111.071 179.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.568 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 81.5 mt-30 -70.53 136.17 49.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.035 -0.53 . . . . 63.130000000000003 109.801 173.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 115.941 -0.572 . . . . 74.420000000000002 111.494 -170.378 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 C--O 1.234 0.269 0 CA-C-O 120.816 0.341 . . . . 61.210000000000001 110.628 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -95.96 13.81 25.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.535 0.683 . . . . 62.119999999999997 109.771 175.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 203' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 3.2 p-10 -133.88 143.42 48.28 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.068 -0.969 . . . . 74.340000000000003 108.57 174.12 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 204' ' ' GLU . . . . . 0.563 ' H ' ' HD2' ' B' ' 208' ' ' TYR . 38.4 tt0 -85.51 -83.48 0.17 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.848 0.356 . . . . 73.319999999999993 111.092 -178.09 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -116.18 0.11 12.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.401 0.62 . . . . 73.420000000000002 110.739 -177.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 206' ' ' ALA . . . . . 0.561 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -143.29 179.9 6.8 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.175 -0.466 . . . . 70.120000000000005 111.629 -174.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 207' ' ' PHE . . . . . 0.429 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.2 OUTLIER -73.51 43.91 0.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.218 -0.901 . . . . 71.230000000000004 112.139 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 208' ' ' TYR . . . . . 0.563 ' HD2' ' H ' ' B' ' 204' ' ' GLU . 59.0 m-85 -60.52 -26.04 66.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.08 0.466 . . . . 75.030000000000001 110.991 -178.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -74.48 -24.04 58.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 72.329999999999998 111.539 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 210' ' ' ARG . . . . . 0.429 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 25.1 mmt180 -89.34 -57.67 2.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.569 -0.287 . . . . 71.430000000000007 111.446 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 211' ' ' ALA . . . . . 0.592 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.55 -26.79 14.21 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.575 0.583 . . . . 60.409999999999997 112.575 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 212' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 7.3 t -69.58 -20.72 63.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.553 0.216 . . . . 43.130000000000003 111.024 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 213' ' ' GLU . . . . . 0.454 ' HB2' HD11 ' A' ' 17' ' ' LEU . 38.9 mt-10 -85.45 -30.56 23.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.065 -0.717 . . . . 75.530000000000001 109.065 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.592 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.01 -50.1 67.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.216 -0.902 . . . . 75.310000000000002 109.962 177.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 215' ' ' ILE . . . . . 0.47 HG13 ' HB1' ' A' ' 39' ' ' ALA . 82.3 mt -65.32 -30.98 51.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.864 -0.607 . . . . 71.019999999999996 110.74 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 216' ' ' LYS . . . . . 0.409 ' HD2' ' O ' ' B' ' 216' ' ' LYS . 0.5 OUTLIER -61.51 -29.8 70.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.892 -0.594 . . . . 71.230000000000004 110.799 -176.762 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.5 tm? -72.01 -41.39 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.493 -0.558 . . . . 73.310000000000002 109.493 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.7 -39.11 79.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.755 -0.657 . . . . 73.239999999999995 111.262 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 219' ' ' ASN . . . . . 0.651 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.1 m-20 -61.89 -34.19 75.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 75.150000000000006 111.31 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -65.64 -34.26 77.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.918 0.389 . . . . 74.540000000000006 111.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -79.67 -26.7 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.139 0.495 . . . . 74.230000000000004 110.406 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -79.27 -9.65 59.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.621 -0.718 . . . . 74.209999999999994 110.417 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 223' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 87.2 mm-40 -73.95 -10.58 59.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.323 -0.399 . . . . 62.43 110.79 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 224' ' ' ASN . . . . . 0.745 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 5.0 t-20 -70.68 112.34 6.84 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.833 -0.803 . . . . 63.009999999999998 108.833 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.7 t -47.85 -38.44 16.12 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 114.461 1.282 . . . . 63.329999999999998 114.461 -170.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -99.06 14.99 27.28 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.369 0.877 . . . . 60.009999999999998 113.369 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 227' ' ' ILE . . . . . 0.745 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 8.1 mm -96.7 154.21 3.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 O-C-N 121.472 -0.767 . . . . 43.399999999999999 110.062 177.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 228' ' ' GLN . . . . . 0.78 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 67.1 mt-30 -91.87 138.76 31.29 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.467 -0.938 . . . . 55.420000000000002 108.467 171.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 36.6 m -58.0 -27.63 63.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.151 0.5 . . . . 64.239999999999995 110.26 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -72.38 -11.6 76.22 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.512 -0.767 . . . . 74.219999999999999 113.631 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 231' ' ' GLU . . . . . 0.78 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 32.4 mt-10 -85.61 -27.54 25.39 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 117.886 0.843 . . . . 73.340000000000003 109.489 178.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.3 t -79.03 -39.48 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.356 -0.838 . . . . 70.340000000000003 110.175 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.6 p -61.08 -42.02 97.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.109 -0.496 . . . . 31.52 110.601 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.06 74.86 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.804 -0.635 . . . . 75.420000000000002 110.989 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 235' ' ' SER . . . . . 0.543 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 34.1 m -66.32 -37.45 85.41 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.867 0.365 . . . . 63.329999999999998 110.122 178.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 236' ' ' PHE . . . . . 0.661 ' CD1' HD12 ' A' ' 14' ' ' LEU . 9.6 t80 -64.6 -37.55 87.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.311 0.577 . . . . 72.219999999999999 109.463 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 237' ' ' MET . . . . . 0.817 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.4 ttm -66.39 -48.57 69.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.519 -0.764 . . . . 74.439999999999998 111.349 177.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 238' ' ' TRP . . . . . 0.485 ' O ' ' HG3' ' B' ' 242' ' ' ARG . 28.0 t-105 -62.14 -41.38 98.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.784 0.326 . . . . 74.510000000000005 110.981 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 239' ' ' ALA . . . . . 0.665 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -63.18 -39.29 94.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.84 0.353 . . . . 63.43 111.068 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 240' ' ' LEU . . . . . 0.717 HD13 ' HB3' ' A' ' 36' ' ' PHE . 42.5 tp -65.8 -36.12 82.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 72.530000000000001 110.503 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 241' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.1 -40.26 95.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.005 -0.543 . . . . 74.340000000000003 110.958 179.135 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 242' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' B' ' 238' ' ' TRP . 44.5 mtp180 -72.09 -37.27 69.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.221 -0.445 . . . . 70.140000000000001 110.073 -178.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -70.78 -40.93 72.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.803 -0.635 . . . . 63.039999999999999 111.013 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -69.28 -28.12 66.02 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.93 0.344 . . . . 63.350000000000001 111.93 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 245' ' ' ALA . . . . . 0.409 ' HB1' ' HG2' ' A' ' 81' ' ' MET . . . -68.82 -18.65 64.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.022 0.439 . . . . 64.430000000000007 111.324 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.8 t90 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.585 -0.734 . . . . 73.420000000000002 111.13 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -72.73 -5.77 40.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 64.530000000000001 112.457 -171.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 248' ' ' GLY . . . . . 0.553 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -58.88 -27.77 62.42 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.469 -0.872 . . . . 33.409999999999997 111.502 175.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 249' ' ' SER . . . . . 0.678 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 27.8 p -67.56 -21.2 65.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.558 -0.321 . . . . 75.140000000000001 111.426 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 26.5 p -91.12 -12.13 36.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.06 0.457 . . . . 74.439999999999998 111.039 -176.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 26.1 t -67.07 -42.53 84.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.659 . . . . 62.009999999999998 111.748 -172.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 252' ' ' PHE . . . . . 0.563 ' HD2' ' HG3' ' B' ' 261' ' ' LYS . 1.3 m-85 -150.61 -178.59 6.64 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.985 0.735 . . . . 74.120000000000005 112.985 -173.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 253' ' ' GLU . . . . . 0.514 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.5 pt-20 -93.13 -53.05 4.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.685 -1.143 . . . . 72.519999999999996 110.753 -176.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 254' ' ' THR . . . . . 0.514 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.0 p -100.84 158.57 15.88 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.086 -0.506 . . . . 73.019999999999996 110.505 -178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 255' ' ' LYS . . . . . 0.412 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.8 ptmt -68.36 -31.25 70.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.425 -0.352 . . . . 73.120000000000005 111.306 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.46 -45.51 93.44 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 54.100000000000001 110.673 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 257' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 90.6 mt-30 -80.49 -35.69 34.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 63.229999999999997 110.129 -179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 258' ' ' MET . . . . . 0.678 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.4 ttt -63.81 -44.89 91.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.512 -0.767 . . . . 61.530000000000001 111.447 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 259' ' ' GLN . . . . . 0.553 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.6 tt0 -61.3 -39.46 90.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.045 -0.525 . . . . 74.510000000000005 111.39 -178.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.68 63.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.158 -0.474 . . . . 74.239999999999995 111.328 -177.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 261' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' B' ' 252' ' ' PHE . 31.9 mmmt -97.51 -5.82 35.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.204 -0.453 . . . . 72.349999999999994 110.897 -176.579 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 262' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -52.67 -54.18 36.95 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.011 0.434 . . . . 71.299999999999997 110.477 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -68.02 -33.05 73.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.091 -0.504 . . . . 70.329999999999998 110.561 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.21 -40.38 78.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.72 -0.673 . . . . 74.239999999999995 111.763 -176.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 265' ' ' MET . . . . . 0.553 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 21.1 ptp -79.82 -25.61 40.77 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.488 0.661 . . . . 73.049999999999997 109.459 -177.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 266' ' ' MET . . . . . 0.43 ' HA ' ' CD2' ' B' ' 269' ' ' TYR . 44.5 mtp -78.32 -42.62 30.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.168 -0.924 . . . . 61.049999999999997 112.681 -176.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.61 -27.34 69.17 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.065 0.394 . . . . 64.230000000000004 112.065 -162.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 268' ' ' TYR . . . . . 0.579 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 30.2 p90 -94.15 -8.12 40.37 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.277 -0.569 . . . . 74.239999999999995 111.133 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 269' ' ' TYR . . . . . 0.43 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.5 m-30 -62.38 -49.69 74.54 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 110.004 -0.369 . . . . 74.439999999999998 110.004 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 270' ' ' MET . . . . . 0.469 ' O ' ' HG3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -53.54 -41.19 66.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.749 0.785 . . . . 63.009999999999998 109.427 175.314 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -86.75 8.85 20.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.516 -1.22 . . . . 74.329999999999998 111.66 -172.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 272' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 6.0 mmm-85 -84.09 -42.44 16.09 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 121.588 -0.695 . . . . 74.109999999999999 110.159 -174.245 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 273' ' ' TYR . . . . . 0.608 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.0 OUTLIER -99.61 14.94 28.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.698 -0.683 . . . . 71.120000000000005 110.318 -178.653 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -58.45 -58.67 7.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 75.409999999999997 109.64 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.2 -35.38 80.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.162 -0.927 . . . . 74.120000000000005 110.879 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.8 mtt -62.45 -42.43 99.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.857 -0.61 . . . . 70.310000000000002 110.285 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 277' ' ' LEU . . . . . 0.596 HD22 ' HG2' ' A' ' 66' ' ' MET . 1.6 tt -70.73 -38.9 73.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.208 -0.906 . . . . 54.450000000000003 110.088 -176.325 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -61.72 -35.37 77.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 71.25 110.048 175.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.54 -13.01 60.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.577 -0.738 . . . . 73.439999999999998 111.271 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -99.69 -9.25 23.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.571 0.701 . . . . 63.229999999999997 109.351 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 281' ' ' MET . . . . . 0.434 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.2 mmt -84.14 -170.07 2.9 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.85 -1.068 . . . . 65.439999999999998 109.786 174.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 282' ' ' GLU . . . . . 0.607 ' HA ' HD12 ' B' ' 285' ' ' ILE . 22.8 mt-10 72.09 -31.68 0.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.248 -0.887 . . . . 74.109999999999999 113.243 169.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -54.62 -54.79 36.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 45.43 110.954 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -68.4 -25.8 65.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.948 -0.569 . . . . 73.129999999999995 110.43 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 285' ' ' ILE . . . . . 0.607 HD12 ' HA ' ' B' ' 282' ' ' GLU . 54.6 mt -71.21 -56.24 11.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.18 -0.464 . . . . 60.210000000000001 110.76 -178.357 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 286' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -65.37 -27.91 68.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.063 0.458 . . . . 74.109999999999999 110.882 -178.001 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -94.53 10.3 35.18 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.431 -0.35 . . . . 72.340000000000003 111.497 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 288' ' ' PHE . . . . . 0.475 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 58.7 t80 -59.78 -48.81 80.2 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.18 -0.304 . . . . 74.409999999999997 110.18 177.32 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.42 -16.97 64.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.331 -0.395 . . . . 72.349999999999994 110.936 177.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -82.1 -53.82 5.78 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.357 -0.608 . . . . 73.319999999999993 109.357 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 291' ' ' TYR . . . . . 0.656 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 62.1 m-85 -64.62 -48.58 74.37 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.072 -0.513 . . . . 75.129999999999995 111.358 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -61.03 -14.89 26.47 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.97 0.414 . . . . 73.340000000000003 110.979 -177.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -98.81 -16.2 18.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.273 -0.421 . . . . 72.519999999999996 111.381 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 21.0 p -119.02 8.5 11.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.171 0.51 . . . . 75.109999999999999 111.21 -176.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 295' ' ' GLN . . . . . 0.656 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 69.2 mt-30 -65.8 153.97 40.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.471 -0.786 . . . . 63.43 111.882 -177.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt . . . . . 0 C--N 1.316 -0.853 0 CA-C-N 114.689 -1.141 . . . . 70.120000000000005 109.288 179.258 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 N--CA 1.451 -0.4 0 N-CA-C 108.436 -0.95 . . . . 65.24 108.436 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -82.3 -81.17 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.519 -0.472 . . . . 72.2 110.65 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -120.4 -11.47 9.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.134 0.492 . . . . 74.24 110.977 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . . . -108.68 169.52 8.61 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.94 -0.573 . . . . 44.12 111.547 -177.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.81 41.98 0.76 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.614 -0.721 . . . . 75.31 111.737 -176.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 6' ' ' ALA . 75.3 m-85 -50.35 -49.91 52.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.388 -0.369 . . . . 74.44 111.645 -176.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.11 88.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.921 -0.581 . . . . 61.42 111.819 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtm105 -72.46 -51.04 21.92 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.961 -0.296 . . . . 74.42 111.618 -176.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.627 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -60.5 -24.72 65.53 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.631 0.729 . . . . 61.34 110.796 -178.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -28.5 68.18 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.062 -0.972 . . . . 75.3 111.468 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.439 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.8 mt-10 -74.87 -29.21 60.95 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.37 0.605 . . . . 71.24 109.47 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -61.24 -45.94 92.47 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.872 -1.058 . . . . 64.24 109.694 177.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 65.1 mt -71.96 -27.06 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.713 -0.676 . . . . 71.41 110.276 177.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.478 ' HD2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -63.36 -31.94 73.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.063 -0.517 . . . . 61.11 110.431 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.583 HD12 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -68.34 -40.12 81.68 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.15 -0.685 . . . . 71.32 109.15 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.77 75.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 72.5 111.054 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.556 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 11.5 m-80 -58.52 -40.78 83.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 74.25 110.785 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.478 HE22 ' HD2' ' A' ' 16' ' ' LYS . 2.9 mp0 -67.12 -34.83 78.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.85 -0.614 . . . . 73.33 111.655 -178.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -76.93 -28.01 55.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.902 0.382 . . . . 75.22 110.675 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.45 ' HB2' HG21 ' A' ' 32' ' ' VAL . 2.6 t-20 -83.81 -6.32 59.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 55.42 110.794 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 46.2 mt-30 -69.97 -11.2 60.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.388 -0.369 . . . . 75.1 111.861 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.735 ' HB3' ' CG1' ' A' ' 27' ' ' ILE . 40.6 t30 -80.3 135.53 36.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.819 -0.437 . . . . 73.42 109.819 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -70.14 -40.58 74.71 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 113.197 0.814 . . . . 63.23 113.197 -170.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -87.43 1.33 53.72 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.433 0.531 . . . . 72.42 112.433 -174.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.735 ' CG1' ' HB3' ' A' ' 24' ' ' ASN . 13.2 mm -86.88 147.78 5.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.178 0.514 . . . . 61.21 109.658 178.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.763 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 2.2 mp0 -82.65 140.8 32.94 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.838 -0.801 . . . . 74.42 108.838 174.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.2 m -59.35 -28.18 66.6 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.147 -0.686 . . . . 73.21 109.147 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.526 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -74.09 -12.48 81.47 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.903 -1.044 . . . . 53.31 113.399 177.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.763 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 43.5 mt-10 -78.63 -35.56 45.33 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 118.079 0.94 . . . . 74.34 109.92 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.45 HG21 ' HB2' ' A' ' 22' ' ' ASN . 21.7 t -74.22 -40.86 51.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.732 -0.667 . . . . 72.42 110.605 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 p -61.52 -44.14 97.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.063 0.458 . . . . 64.32 110.255 176.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.43 -31.03 71.91 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.659 -0.701 . . . . 73.22 110.982 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 63.4 m -67.89 -42.46 81.17 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.029 -0.36 . . . . 73.34 110.029 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.602 ' CD1' HD12 ' B' ' 214' ' ' LEU . 4.0 t80 -64.61 -33.72 76.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.698 0.761 . . . . 74.41 109.093 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.658 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.1 tpt -62.23 -60.08 4.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.646 -1.161 . . . . 64.21 110.935 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.445 ' CZ2' ' HD3' ' A' ' 42' ' ' ARG . 25.7 t-105 -59.36 -33.89 71.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.354 -0.839 . . . . 65.52 111.303 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.482 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.34 -42.99 95.97 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.232 -0.44 . . . . 55.34 110.991 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.588 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.3 tp -68.83 -34.09 74.91 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 110.024 -0.361 . . . . 64.02 110.024 178.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -33.11 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 61.51 111.107 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.485 ' HG2' ' ND2' ' B' ' 280' ' ' ASN . 28.5 mtm180 -87.27 -45.59 10.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.387 -0.369 . . . . 64.42 111.061 178.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.517 ' HD2' HG23 ' B' ' 215' ' ' ILE . 18.5 t80 -68.18 -33.2 74.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.132 -0.485 . . . . 73.4 111.458 -173.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -86.49 -22.96 26.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.726 0.298 . . . . 73.31 111.6 -173.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.25 -10.4 59.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.45 0.643 . . . . 62.22 110.656 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -59.74 -24.9 64.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.014 -0.994 . . . . 72.05 111.57 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.403 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 75.3 m-85 -86.65 -0.53 56.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.039 0.385 . . . . 60.25 112.039 -176.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.12 -29.68 75.95 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 119.982 -1.104 . . . . 41.42 110.751 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.6 m -71.57 -5.45 33.41 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.254 -0.473 . . . . 64.45 111.825 -176.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -119.24 14.84 13.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.982 0.42 . . . . 71.23 111.15 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.95 -47.76 11.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 75.42 110.476 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.621 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 12.8 m-85 -142.47 165.07 28.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 116.121 -0.49 . . . . 65.24 110.145 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.428 ' HG2' ' N ' ' A' ' 54' ' ' THR . 1.6 pm0 -82.12 -41.77 20.03 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.136 -0.938 . . . . 64.14 111.362 -171.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.428 ' N ' ' HG2' ' A' ' 53' ' ' GLU . 65.4 p -100.92 149.16 24.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.99 -0.55 . . . . 75.45 109.739 178.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.504 ' HB2' HG23 ' B' ' 285' ' ' ILE . 13.2 pttm -68.07 -25.13 65.2 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.57 -0.53 . . . . 72.14 109.57 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -60.49 -49.77 76.22 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.536 -0.756 . . . . 52.1 110.574 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.54 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -81.08 -24.69 37.6 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.291 -0.413 . . . . 65.42 110.341 -178.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.497 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 11.7 ttt -71.8 -44.47 63.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.604 -0.725 . . . . 74.23 111.194 178.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 35.4 tt0 -62.68 -36.32 82.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 74.12 111.371 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.01 -15.03 63.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.152 0.501 . . . . 73.43 111.313 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.621 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 32.0 mmmt -99.13 1.58 45.17 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.178 -0.465 . . . . 73.32 111.054 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 0.2 OUTLIER -52.37 -48.52 65.53 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.457 0.473 . . . . 70.41 110.469 -176.465 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.596 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 14.3 tp60 -72.3 -28.74 63.28 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.223 -0.444 . . . . 75.22 110.588 -175.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -78.17 -37.06 46.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.852 -0.613 . . . . 61.42 111.378 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 21.7 ptp -79.71 -26.12 40.95 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.092 -0.707 . . . . 62.11 109.092 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.53 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 88.7 mtp -81.23 -13.22 58.75 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.398 -0.819 . . . . 60.15 111.53 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -65.33 -26.96 68.27 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 122.115 0.96 . . . . 70.23 108.793 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -102.78 16.0 27.75 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.113 -1.403 . . . . 74.54 111.564 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.53 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.7 m-30 -106.83 -45.74 4.12 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.985 -0.746 . . . . 74.42 108.985 172.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -65.38 -60.66 2.73 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.983 0.421 . . . . 72.24 110.876 174.604 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -73.84 -16.6 61.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.34 1.237 . . . . 72.41 114.34 -168.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -96.92 3.04 52.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 113.641 0.978 . . . . 73.54 113.641 -158.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.582 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 7.42 11.51 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.652 -0.704 . . . . 72.21 109.203 167.623 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.439 ' O ' ' HE1' ' B' ' 266' ' ' MET . 2.6 pttm -78.78 -39.13 36.72 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.594 -0.73 . . . . 45.31 111.41 -172.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.544 ' CD ' ' H ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -70.23 -31.18 68.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.101 0.476 . . . . 70.33 110.04 -179.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.6 mtm -77.04 -27.97 54.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.68 -0.691 . . . . 62.03 110.038 176.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 6.8 tt -70.51 -46.86 62.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 61.45 109.778 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.436 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -60.34 -32.23 71.05 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.054 -0.521 . . . . 70.5 110.765 176.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.6 -15.31 62.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.919 -0.582 . . . . 64.41 111.48 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -104.9 -10.26 17.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.812 0.339 . . . . 75.21 110.537 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.44 ' O ' HG13 ' A' ' 85' ' ' ILE . 17.0 mmt -68.97 -48.36 63.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 74.15 110.511 177.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 24.0 mm-40 -56.54 -30.28 62.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.686 -0.688 . . . . 73.2 111.743 -177.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -56.03 -25.76 46.04 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.039 0.447 . . . . 74.21 110.975 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -107.69 -32.25 7.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.17 -0.468 . . . . 74.33 110.879 177.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 81' ' ' MET . 62.7 mt -70.61 -63.65 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 111.932 0.345 . . . . 70.52 111.932 -176.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.728 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 0.9 OUTLIER -76.81 -3.26 37.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.045 0.45 . . . . 70.22 111.268 -174.525 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -107.98 3.85 24.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.688 -0.687 . . . . 52.3 110.448 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -52.55 -52.84 52.95 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.293 -0.412 . . . . 74.4 110.936 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.118 -0.492 . . . . 55.12 110.753 -177.94 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.439 -0.578 . . . . 64.02 109.439 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -81.45 -90.58 0.07 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.899 0.381 . . . . 60.14 110.894 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -106.11 -26.14 11.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 54.14 110.679 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.434 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -100.23 162.35 13.02 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.117 -0.492 . . . . 71.11 111.161 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -75.9 43.83 0.28 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.42 -0.809 . . . . 72.1 112.602 -176.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' B' ' 206' ' ' ALA . 70.9 m-85 -54.17 -41.64 68.74 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.837 0.351 . . . . 73.13 111.321 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.7 -19.8 63.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.837 -0.62 . . . . 63.41 112.035 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.412 HH12 HD12 ' A' ' 27' ' ' ILE . 49.2 mtm180 -92.9 -56.97 2.79 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.943 -0.303 . . . . 75.23 110.799 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.715 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -51.51 -27.37 10.47 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.539 0.57 . . . . 52.52 112.539 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.6 t -69.5 -20.95 63.71 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 121.058 -0.257 . . . . 60.43 111.363 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.406 ' HB2' HD11 ' A' ' 17' ' ' LEU . 49.8 mt-10 -81.12 -29.46 34.82 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.254 -0.647 . . . . 70.5 109.254 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.715 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.0 mm? -63.64 -46.54 85.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.975 -1.011 . . . . 72.03 108.96 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.517 HG23 ' HD2' ' A' ' 43' ' ' TYR . 74.6 mt -67.59 -32.66 57.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.404 -0.816 . . . . 73.54 110.253 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 2.1 tmmt? -60.39 -36.86 79.09 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.64 -0.709 . . . . 75.31 111.167 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.528 HD12 HD13 ' A' ' 14' ' ' LEU . 3.2 tm? -63.27 -41.18 99.0 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.787 -0.82 . . . . 72.43 108.787 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.11 -28.99 68.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 53.34 110.849 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 0.9 OUTLIER -64.35 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 65.43 111.036 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . 0.403 HE22 ' HD2' ' B' ' 216' ' ' LYS . 2.8 mp0 -66.82 -39.95 87.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 62.41 111.196 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.84 -22.2 53.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.446 0.641 . . . . 75.02 109.945 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.34 -3.31 52.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.167 -0.924 . . . . 61.52 110.419 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 52.0 mt-30 -78.93 -8.18 58.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.421 -0.354 . . . . 52.34 110.864 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.546 HD22 HG13 ' B' ' 227' ' ' ILE . 1.7 t30 -81.84 105.21 12.78 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.646 -0.501 . . . . 72.31 109.646 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.6 t -59.43 -32.34 70.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.305 0.854 . . . . 75.34 113.305 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . 0.501 ' HG2' ' ND2' ' B' ' 224' ' ' ASN . 12.4 pt-20 -79.01 -12.4 60.03 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.795 -0.362 . . . . 74.11 111.068 -175.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.546 HG13 HD22 ' B' ' 224' ' ' ASN . 10.0 mt -97.82 150.0 4.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.104 0.478 . . . . 63.21 109.966 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -85.87 150.7 24.34 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.814 -0.63 . . . . 71.21 109.752 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.3 m -57.53 -23.92 53.08 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.674 -0.694 . . . . 73.41 110.277 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . 0.403 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.96 -25.62 75.44 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.348 -0.842 . . . . 55.04 113.692 -179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -76.64 -13.58 60.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 117.876 0.838 . . . . 73.34 110.392 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 12.6 t -90.96 -42.06 13.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.705 -0.68 . . . . 50.24 109.858 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 25.2 p -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.112 -0.494 . . . . 74.35 110.642 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.65 -33.1 74.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.124 -0.489 . . . . 60.14 110.693 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 38.7 m -67.68 -40.76 84.4 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.921 -0.4 . . . . 73.14 109.921 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.625 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.9 t80 -63.07 -35.63 80.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.539 0.685 . . . . 75.52 109.478 176.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.588 ' SD ' HD21 ' A' ' 40' ' ' LEU . 8.4 tpt -59.45 -60.74 3.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.796 -1.093 . . . . 75.23 110.808 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.403 ' CZ2' ' HD3' ' B' ' 242' ' ' ARG . 25.3 t-105 -59.56 -36.26 75.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.228 -0.896 . . . . 74.54 111.532 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -64.41 -44.4 91.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.394 -0.366 . . . . 73.22 111.411 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.658 HD21 ' SD ' ' A' ' 37' ' ' MET . 43.5 tp -65.69 -33.94 77.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.4 . . . . 75.32 110.658 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.538 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.81 -43.6 97.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.95 -0.568 . . . . 32.24 110.924 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . 0.403 ' HD3' ' CZ2' ' B' ' 238' ' ' TRP . 68.6 mtm180 -70.95 -36.09 72.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 62.14 110.988 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -72.77 -39.17 66.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.336 -0.393 . . . . 65.33 110.725 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -72.69 -32.08 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.395 -0.366 . . . . 54.44 111.98 -177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -67.45 -14.74 63.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.971 0.415 . . . . 72.23 111.371 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 80.2 t90 -60.56 -38.68 85.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.052 -0.522 . . . . 61.4 110.962 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.526 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 62.0 m-85 -68.6 -13.92 62.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.288 0.477 . . . . 74.32 112.288 -175.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -61.44 -33.81 86.05 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.419 -0.896 . . . . 35.53 111.767 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . 0.626 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 70.1 p -65.92 -23.75 66.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.807 0.336 . . . . 71.1 111.756 -176.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 14.5 t -108.83 22.19 16.24 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.227 0.537 . . . . 75.14 110.444 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.4 t -87.13 -55.32 3.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.175 -0.466 . . . . 64.21 110.939 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.624 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -130.03 -179.65 5.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.083 0.468 . . . . 74.54 111.842 -177.313 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.417 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.2 pt-20 -89.87 -41.85 11.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.238 -0.892 . . . . 75.34 111.539 -173.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.417 HG23 ' HG3' ' B' ' 253' ' ' GLU . 81.9 p -117.31 151.92 35.97 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 110.026 -0.361 . . . . 75.25 110.026 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.728 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 12.7 ptmm? -65.77 -25.8 67.42 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.373 0.421 . . . . 70.22 110.441 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -56.19 -54.58 43.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 73.33 110.217 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.643 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 16.3 mt-30 -79.43 -36.3 39.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.582 -0.735 . . . . 71.14 110.03 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.626 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 12.0 ttt -59.93 -46.79 88.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.488 -0.778 . . . . 62.12 111.577 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 33.5 tt0 -65.3 -30.27 71.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.953 0.406 . . . . 71.03 110.96 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -77.55 -9.94 59.21 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.17 -0.468 . . . . 64.21 110.897 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.643 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.8 mmmt -104.14 -1.13 27.72 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 116.263 -0.426 . . . . 61.4 110.693 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' B' ' 259' ' ' GLN . 17.1 ptpt -57.5 -45.51 84.84 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.39 -0.368 . . . . 55.45 110.963 -174.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.507 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 12.2 tp60 -73.4 -19.56 60.96 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.058 -0.257 . . . . 75.21 110.924 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -83.26 -33.95 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 74.21 110.908 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' B' ' 262' ' ' LYS . 22.6 ptp -79.93 -26.99 39.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.962 -1.125 . . . . 72.05 107.962 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.45 ' HG2' HD22 ' A' ' 77' ' ' LEU . 73.1 mtp -89.92 23.86 2.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.55 -1.205 . . . . 73.42 110.168 174.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -104.28 -29.43 10.79 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.13 -1.063 . . . . 65.44 108.13 167.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.419 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.6 m-85 -98.21 9.24 43.43 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.685 -1.143 . . . . 61.1 112.039 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -94.71 -68.19 0.81 Allowed 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.543 -1.28 . . . . 74.14 107.543 166.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -51.3 -61.29 2.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.134 -0.939 . . . . 73.3 110.756 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -85.15 19.4 2.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.288 -0.869 . . . . 70.34 112.483 -166.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.419 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 17.6 mmm180 -121.72 -30.7 4.11 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 121.346 -0.846 . . . . 72.44 112.564 -175.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.47 ' HE2' ' HG ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -83.75 1.37 43.11 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.533 -1.284 . . . . 64.14 107.533 172.14 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.476 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 73.5 tttt -58.76 -58.26 9.37 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 112.929 -1.941 . . . . 71.42 111.279 178.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -32.51 74.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.445 . . . . 63.35 111.284 -176.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 39.1 mtm -78.59 -21.97 47.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.203 0.525 . . . . 64.23 110.08 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.448 HD22 ' HG2' ' A' ' 66' ' ' MET . 5.6 tt -76.43 -47.14 24.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.665 -0.698 . . . . 62.01 110.004 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . 0.405 ' HB2' ' HE1' ' A' ' 66' ' ' MET . 36.1 t70 -67.15 -26.21 66.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.208 0.528 . . . . 63.54 110.416 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.01 66.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.603 -0.726 . . . . 71.44 110.777 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . 0.485 ' ND2' ' HG2' ' A' ' 42' ' ' ARG . 35.7 m-80 -89.17 -30.04 18.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.305 -0.407 . . . . 63.24 110.244 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.623 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -56.08 -58.77 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 75.14 110.184 176.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 14.9 mm-40 -51.71 -37.33 50.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.612 -0.722 . . . . 75.45 112.081 -178.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.27 -52.37 65.6 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.255 0.347 . . . . 55.4 110.65 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -70.42 -38.29 74.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.399 -0.364 . . . . 64.42 110.941 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.623 HG13 ' O ' ' B' ' 281' ' ' MET . 61.3 mt -59.9 -59.61 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 73.41 111.312 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 5.9 pt-20 -60.0 -29.72 68.66 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.906 0.384 . . . . 65.11 111.204 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -90.86 9.44 30.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.423 -0.353 . . . . 72.43 111.602 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.46 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 39.1 t80 -60.49 -45.33 94.16 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.805 -0.443 . . . . 75.32 109.805 173.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 . . . . . 0 N--CA 1.465 0.324 0 CA-C-N 115.929 -0.578 . . . . 74.14 110.616 176.585 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 6' ' ' ALA . 8.4 m120 . . . . . 0 N--CA 1.452 -0.331 0 N-CA-C 109.222 -0.658 . . . . 71.01 109.222 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -55.07 -73.09 0.06 Allowed 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.341 0.401 . . . . 65.11 111.402 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -133.22 -17.34 2.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.15 0.5 . . . . 74.21 110.694 177.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -107.48 163.27 13.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.96 -0.564 . . . . 51.42 111.674 -175.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.498 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.18 47.57 1.15 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.151 -0.931 . . . . 70.13 110.428 176.059 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 6' ' ' ALA . 73.2 m-85 -45.32 -52.09 10.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.032 -0.531 . . . . 74.45 111.492 -175.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.1 -34.93 74.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 55.52 111.972 -175.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -65.25 -54.05 35.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.374 -0.375 . . . . 74.41 110.497 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.69 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -74.19 -11.6 60.34 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.823 0.82 . . . . 65.25 110.265 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -70.23 -28.15 65.03 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.522 -1.217 . . . . 64.14 110.292 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.454 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.3 mm-40 -82.66 -27.3 31.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.48 0.657 . . . . 73.45 109.758 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -65.23 -49.89 67.94 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.081 -0.963 . . . . 64.53 109.446 176.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.505 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.1 mt -65.15 -30.17 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.796 -0.638 . . . . 74.13 110.201 175.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.721 ' HD3' HE22 ' A' ' 20' ' ' GLN . 5.3 tmtt? -57.98 -45.87 86.07 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.477 -0.783 . . . . 74.04 110.504 -179.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.465 HD12 HD13 ' B' ' 214' ' ' LEU . 1.8 tm? -56.04 -45.33 79.23 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.675 -0.491 . . . . 52.2 109.675 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.64 -28.43 65.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.688 -0.687 . . . . 63.55 111.287 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.626 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 23.4 m-80 -69.53 -26.89 64.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 71.22 111.374 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.721 HE22 ' HD3' ' A' ' 16' ' ' LYS . 2.6 mp0 -76.12 -30.54 58.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.246 0.546 . . . . 74.33 110.383 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -86.81 -16.98 34.57 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.89 -0.595 . . . . 64.24 110.007 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 22' ' ' ASN . 2.6 t-20 -84.57 -2.99 58.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.769 -0.65 . . . . 52.33 109.549 173.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 93.6 mt-30 -79.2 -2.16 39.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.807 -0.633 . . . . 74.03 109.718 173.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.594 HD22 HG13 ' A' ' 27' ' ' ILE . 2.3 t30 -74.84 106.85 6.57 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.1 -1.074 . . . . 54.0 108.1 172.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.2 t -53.53 -40.6 65.63 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 113.825 1.046 . . . . 62.23 113.825 -167.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -78.91 -21.01 47.98 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 112.36 0.504 . . . . 74.23 112.36 -176.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.594 HG13 HD22 ' A' ' 24' ' ' ASN . 11.1 mt -84.87 144.57 9.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.171 0.51 . . . . 74.52 110.139 -176.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.563 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -86.4 156.39 20.19 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.68 -0.691 . . . . 63.3 109.183 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.1 m -60.62 -30.55 69.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.292 0.567 . . . . 74.01 109.785 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.477 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -81.95 1.9 85.25 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.326 -0.852 . . . . 23.24 113.589 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.563 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 21.6 mm-40 -97.33 -19.46 18.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.85 0.825 . . . . 63.44 109.733 175.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.6 t -81.46 -25.92 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.739 -0.664 . . . . 72.12 110.169 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 p -59.9 -32.86 71.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.654 -0.703 . . . . 60.12 111.153 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.27 -34.3 75.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.187 -0.461 . . . . 52.22 110.71 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 m -69.26 -37.53 77.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 74.13 109.896 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.577 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 6.7 t80 -68.95 -35.16 76.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.743 -0.662 . . . . 73.02 109.644 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.765 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 3.9 ttm -70.7 -46.68 62.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.74 -0.664 . . . . 51.43 111.455 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -60.1 -39.57 86.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.108 0.48 . . . . 74.14 110.331 176.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.58 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.24 -39.7 93.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.895 -0.593 . . . . 74.12 111.115 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.769 HD21 ' SD ' ' B' ' 237' ' ' MET . 44.0 tp -65.04 -34.8 79.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.363 . . . . 71.14 110.475 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.99 -48.4 82.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.485 . . . . 65.34 110.75 177.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' OD1' ' B' ' 280' ' ' ASN . 20.7 mtm180 -68.81 -23.4 64.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 70.14 111.051 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.458 ' HD2' HG23 ' B' ' 215' ' ' ILE . 15.3 t80 -83.7 -31.35 26.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 72.42 110.735 -178.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -79.42 -26.01 41.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.786 0.326 . . . . 55.41 111.179 179.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB2' HD23 ' B' ' 277' ' ' LEU . . . -87.55 13.07 10.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.351 0.596 . . . . 42.44 110.784 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -76.81 -13.86 59.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.485 -0.779 . . . . 74.11 110.409 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.15 -86.87 0.34 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.429 -0.582 . . . . 74.42 109.429 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.67 -60.43 0.69 Allowed Glycine 0 C--N 1.333 0.361 0 O-C-N 123.357 0.411 . . . . 64.44 112.915 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.4 p -75.47 -1.6 24.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.221 0.534 . . . . 72.11 110.958 -176.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 p -65.84 -31.87 73.07 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.544 . . . . 52.34 111.392 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -74.22 -45.79 45.94 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.927 -0.579 . . . . 71.22 111.486 -178.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.518 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 15.9 m-85 -153.09 167.4 29.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.49 0.662 . . . . 52.54 112.106 -173.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 54' ' ' THR . 1.8 pm0 -91.18 -51.41 5.33 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.353 -1.294 . . . . 74.4 111.402 -175.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.546 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 65.6 p -90.14 148.26 23.09 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 116.678 -0.237 . . . . 74.22 110.514 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.493 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 13.9 ptmm? -66.28 -26.21 67.23 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.337 -0.392 . . . . 62.22 110.478 -176.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -57.39 -42.81 82.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.766 -0.652 . . . . 75.52 111.049 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 11.5 mt-30 -93.92 -35.57 12.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.969 -0.56 . . . . 63.31 110.039 -177.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.493 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 15.6 ttt -62.01 -47.88 82.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.364 -0.835 . . . . 74.51 111.449 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.81 -30.59 71.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 51.52 111.05 -176.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.88 -5.35 43.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.113 -0.494 . . . . 63.43 111.446 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.79 ' HE3' ' HG2' ' A' ' 64' ' ' GLU . 28.9 mmmt -116.04 5.36 13.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.448 -0.342 . . . . 70.15 110.201 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -57.58 -54.84 42.3 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.306 -0.406 . . . . 71.11 110.249 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -68.64 -27.92 66.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.37 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.79 ' HG2' ' HE3' ' A' ' 61' ' ' LYS . 5.5 tp10 -65.23 -45.28 85.3 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 116.033 -0.531 . . . . 74.25 110.857 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.642 ' HA ' ' HE1' ' A' ' 68' ' ' TYR . 20.5 ptp -77.75 -26.28 49.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.402 0.62 . . . . 41.23 109.375 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.467 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 65.6 mtp -80.94 -29.69 35.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.551 -0.75 . . . . 71.44 112.563 -177.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -64.22 -40.09 95.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.074 0.464 . . . . 75.33 110.725 -169.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.682 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 36.4 p90 -88.04 -12.15 45.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.931 -0.577 . . . . 71.24 110.493 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.474 ' O ' ' HE1' ' B' ' 237' ' ' MET . 2.3 m-30 -60.55 -44.7 95.83 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.229 -0.188 . . . . 71.53 110.623 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.687 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.55 -49.68 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.975 0.417 . . . . 61.32 110.05 173.679 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -85.19 47.91 1.49 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.605 0.717 . . . . 75.51 110.757 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.682 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 1.9 mmp_? -113.06 -23.07 10.23 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 121.705 -0.622 . . . . 73.21 111.158 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 1.035 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 9.1 11.86 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.621 -0.432 . . . . 65.11 110.983 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -64.05 -59.16 4.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.485 -0.325 . . . . 72.22 110.531 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -55.82 -37.83 69.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 74.24 111.321 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.8 mtt -61.79 -42.11 98.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.484 0.659 . . . . 71.25 110.332 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' B' ' 245' ' ' ALA . 2.0 tt -69.18 -36.28 77.16 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.229 -0.896 . . . . 75.44 109.304 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.483 ' N ' ' HE1' ' B' ' 266' ' ' MET . 12.1 t70 -61.45 -43.27 99.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.02 -0.991 . . . . 74.02 110.805 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.06 -14.28 62.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.514 -0.766 . . . . 73.54 111.814 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -99.55 -4.98 29.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.82 0.343 . . . . 72.24 111.004 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.44 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 19.0 mmt -80.73 -178.76 6.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.334 0.588 . . . . 60.23 111.569 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.713 ' HG2' HD12 ' A' ' 85' ' ' ILE . 3.8 mt-10 67.64 -2.33 1.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.641 -1.163 . . . . 74.41 114.059 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.96 -53.99 45.17 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.031 0.443 . . . . 55.13 109.95 177.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -85.4 -9.52 57.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 63.15 111.255 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.713 HD12 ' HG2' ' A' ' 82' ' ' GLU . 61.6 mt -79.34 -62.2 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.889 0.376 . . . . 62.13 110.897 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.618 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -66.8 -24.08 66.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.346 -0.388 . . . . 74.54 110.72 -176.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.423 ' ND2' ' HG3' ' A' ' 86' ' ' GLU . 47.8 m-80 -107.07 16.69 23.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.057 -0.52 . . . . 71.43 111.111 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.553 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 63.3 t80 -53.94 -49.41 68.75 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.556 0.206 . . . . 75.5 111.556 -177.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.6 t70 . . . . . 0 C--N 1.327 -0.39 0 CA-C-O 121.067 0.46 . . . . 64.01 111.273 -179.692 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.418 HD22 ' N ' ' B' ' 203' ' ' ASN . 0.9 OUTLIER . . . . . 0 CA--C 1.519 -0.236 0 CA-C-O 120.896 0.379 . . . . 74.24 110.247 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -96.35 100.28 11.9 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.18 -0.464 . . . . 74.55 110.794 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.9 25.22 3.9 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.748 0.785 . . . . 74.54 109.14 172.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -152.75 -176.24 5.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 74.45 111.904 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -130.16 42.15 3.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 71.31 110.254 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -52.14 -41.05 62.21 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.642 -0.708 . . . . 74.52 111.843 -177.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.09 -20.7 64.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 71.04 111.431 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -85.36 -65.2 1.04 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.287 -0.415 . . . . 71.44 110.091 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.627 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.82 -25.98 13.11 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.432 0.901 . . . . 70.42 113.432 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.8 t -65.63 -28.04 68.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.632 0.253 . . . . 72.41 111.318 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.7 -18.71 39.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.221 0.534 . . . . 65.11 110.251 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -71.37 -46.19 61.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.566 -0.743 . . . . 72.5 109.461 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.58 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.8 mt -67.2 -30.79 50.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.427 0.632 . . . . 72.55 109.905 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -57.55 -39.96 77.84 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.188 -0.914 . . . . 75.43 111.084 -177.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 14' ' ' LEU . 2.8 tm? -63.66 -42.6 98.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.354 -0.385 . . . . 71.44 110.052 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.41 -33.2 72.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 43.55 111.402 -177.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.79 -32.73 73.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.304 -0.407 . . . . 72.21 111.109 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -74.14 -28.22 61.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 72.44 111.264 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -85.18 -21.18 29.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.923 0.392 . . . . 74.51 110.519 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -78.13 -1.97 35.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.469 0.652 . . . . 73.44 109.854 175.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -79.45 -4.43 51.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.877 -0.601 . . . . 54.52 109.944 175.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.475 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -69.93 103.52 2.26 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.955 -0.758 . . . . 44.42 108.955 175.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.9 t -59.86 -26.51 65.91 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 113.287 0.847 . . . . 73.51 113.287 -171.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . 0.475 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.6 pm0 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.226 0.454 . . . . 64.33 112.226 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.41 HG13 HD22 ' B' ' 224' ' ' ASN . 4.2 mt -115.97 150.47 17.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.395 . . . . 72.32 110.943 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -88.76 166.35 14.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.094 -0.503 . . . . 74.1 109.783 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 10.4 m -67.22 -27.01 66.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.301 -0.409 . . . . 74.43 110.659 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -66.52 -27.44 73.16 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.938 -0.574 . . . . 61.25 113.322 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -74.4 -29.36 61.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.223 0.535 . . . . 73.34 109.778 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.8 t -76.29 -26.23 16.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 70.45 109.695 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . 0.445 ' HA ' ' CE1' ' A' ' 43' ' ' TYR . 2.7 m -65.57 -24.68 67.15 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.819 -0.628 . . . . 75.42 109.75 174.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -85.51 -33.06 21.89 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.597 -0.729 . . . . 61.43 111.348 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.498 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 9.2 p -68.77 -34.36 75.44 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 120.7 -0.4 . . . . 61.21 110.41 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.64 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.3 t80 -67.18 -36.33 81.56 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.14 -0.689 . . . . 71.34 109.14 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 1.035 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.4 tpt -62.66 -57.5 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.142 -0.935 . . . . 64.12 110.554 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.498 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 31.1 t-105 -60.23 -35.62 75.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.455 -0.793 . . . . 73.21 111.643 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.504 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -62.65 -47.11 85.13 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.701 0.286 . . . . 71.4 110.945 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.562 HD13 ' HB3' ' A' ' 36' ' ' PHE . 40.0 tp -62.83 -28.21 69.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 72.12 110.872 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -66.09 -49.44 67.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 45.43 110.908 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.6 mtm180 -68.76 -23.7 64.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.401 . . . . 53.51 110.862 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.505 ' HD2' HG23 ' A' ' 15' ' ' ILE . 13.7 t80 -78.9 -26.41 43.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.238 -0.437 . . . . 73.51 110.58 -179.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -90.61 -24.75 20.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.854 0.316 . . . . 72.53 111.854 -178.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.488 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -83.66 2.3 38.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.532 0.682 . . . . 60.54 110.285 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -76.3 -9.21 58.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.803 -1.09 . . . . 64.43 109.929 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.56 ' HB3' ' OG1' ' B' ' 250' ' ' THR . 80.2 m-85 -95.94 -89.07 0.26 Allowed 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.912 -0.773 . . . . 75.32 108.912 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . 64.63 -66.73 0.07 OUTLIER Glycine 0 C--N 1.334 0.437 0 O-C-N 123.663 0.602 . . . . 52.03 113.325 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 3.5 p -75.06 -3.34 31.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.107 0.48 . . . . 63.5 111.043 -175.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . 0.56 ' OG1' ' HB3' ' B' ' 247' ' ' PHE . 24.1 p -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.948 -0.569 . . . . 75.3 111.038 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.2 t -86.4 -39.88 15.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.897 -0.592 . . . . 63.31 111.236 -177.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.55 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 4.0 m-85 -147.67 179.24 7.84 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.772 0.656 . . . . 75.22 112.772 -173.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.505 ' HG3' ' N ' ' B' ' 254' ' ' THR . 7.9 pt-20 -89.7 -50.98 5.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.035 -0.984 . . . . 64.05 111.334 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.54 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 68.9 p -107.33 159.44 16.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.071 -0.513 . . . . 61.41 111.063 -173.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.553 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 20.2 ptmt -67.28 -32.07 72.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.471 -0.331 . . . . 74.51 110.814 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . 0.54 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.7 mp0 -57.56 -42.73 83.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.167 0.508 . . . . 74.44 110.46 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 14.1 mt-30 -89.7 -34.97 16.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.677 -0.692 . . . . 63.5 110.266 -177.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.404 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 14.8 ttt -63.5 -42.34 98.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.828 -0.624 . . . . 74.35 110.892 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.581 ' HG3' ' HE3' ' B' ' 262' ' ' LYS . 34.6 tt0 -62.64 -37.3 85.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 71.34 111.005 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.17 -9.0 50.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 52.42 111.159 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.55 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 30.9 mmmt -109.21 1.07 20.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.115 -0.493 . . . . 64.14 111.529 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.581 ' HE3' ' HG3' ' B' ' 259' ' ' GLN . 8.2 ptpp? -58.38 -39.74 80.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.711 0.291 . . . . 64.44 110.594 -175.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -90.1 -24.48 21.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 110.085 -0.339 . . . . 65.14 110.085 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . 0.415 ' HB2' ' HA ' ' B' ' 261' ' ' LYS . 45.8 mt-10 -75.17 -33.26 61.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 61.14 111.802 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.2 ptp -77.87 -30.42 50.82 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.073 -1.084 . . . . 72.11 108.073 175.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.483 ' HE1' ' N ' ' A' ' 78' ' ' ASP . 45.2 mtp -87.33 16.47 5.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.981 -1.008 . . . . 70.03 110.703 177.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -91.79 -37.71 12.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.249 0.547 . . . . 54.01 110.072 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.512 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 13.9 p90 -109.06 -5.91 15.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.879 -0.6 . . . . 63.44 110.925 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -57.75 -48.01 80.86 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.634 0.254 . . . . 75.41 110.752 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.687 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.71 -53.37 58.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.923 -0.581 . . . . 62.02 110.809 175.443 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.39 65.21 8.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.366 0.603 . . . . 74.42 111.444 -173.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.597 ' HB2' ' SD ' ' A' ' 37' ' ' MET . 85.2 mtm180 -125.63 -27.83 3.35 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.78 -0.645 . . . . 73.22 109.522 170.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.765 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -104.1 14.45 30.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.282 -0.417 . . . . 54.25 110.441 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -63.99 -58.76 5.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 75.25 109.828 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.51 -36.03 79.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 74.34 111.146 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 61.0 mtt -58.02 -46.77 84.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.316 0.579 . . . . 61.43 109.663 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.511 HD23 ' HB2' ' A' ' 45' ' ' ALA . 0.9 OUTLIER -67.02 -37.73 84.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.814 -1.085 . . . . 62.42 109.729 -177.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . 0.467 ' N ' ' HE1' ' A' ' 66' ' ' MET . 13.8 t70 -64.06 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.499 -0.773 . . . . 75.12 110.092 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -72.37 -18.3 61.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.661 -0.7 . . . . 63.52 111.144 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . 0.444 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m120 -89.64 -20.07 24.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.066 0.46 . . . . 72.24 109.798 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.46 ' C ' ' H ' ' B' ' 283' ' ' ASP . 24.3 mmt -73.67 -165.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 74.3 110.172 173.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 6.5 mm-40 66.48 -34.59 0.21 Allowed 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.339 1.056 . . . . 75.01 112.989 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' B' ' 281' ' ' MET . 18.2 t70 -47.9 -60.07 2.87 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.436 0.694 . . . . 63.42 112.236 -177.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -80.55 -13.33 59.16 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.213 -0.449 . . . . 65.44 110.808 -177.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.79 -53.61 13.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.116 -0.493 . . . . 72.11 110.307 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.596 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -63.15 -32.21 73.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.137 -0.483 . . . . 72.34 110.211 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 30.1 m-80 -90.49 11.96 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.792 -0.64 . . . . 75.31 111.922 -176.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 54' ' ' THR . 38.3 t80 -58.18 -43.4 87.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.86 -0.793 . . . . 74.42 108.86 172.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.47 -0.786 . . . . 63.53 110.343 173.992 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.491 ' HA ' ' HD2' ' A' ' 8' ' ' TYR . 4.6 p-10 . . . . . 0 N--CA 1.448 -0.566 0 CA-C-O 121.783 0.801 . . . . 72.34 109.209 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -84.22 -72.25 0.47 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.313 -0.858 . . . . 71.32 112.212 -169.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -89.46 -15.11 33.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.295 0.569 . . . . 55.21 110.712 -171.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . . . -139.13 167.11 22.8 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.944 -0.571 . . . . 75.23 111.615 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.53 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.66 47.35 1.17 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.17 -0.923 . . . . 73.23 111.398 -179.171 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.491 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 68.7 m-85 -49.66 -42.22 44.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.378 . . . . 74.12 111.907 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.18 -18.8 64.7 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.194 0.442 . . . . 73.51 112.194 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -83.62 -53.92 5.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.527 0.203 . . . . 73.51 111.06 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.752 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -66.74 -17.04 64.66 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.89 0.853 . . . . 45.03 109.932 -176.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -55.53 -35.93 66.19 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.03 -1.441 . . . . 74.44 111.535 175.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.658 ' HB2' HD11 ' B' ' 217' ' ' LEU . 25.6 mt-10 -83.68 -24.82 31.13 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.125 0.488 . . . . 74.5 110.126 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -67.12 -44.55 79.61 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.66 -0.7 . . . . 73.41 109.9 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 67.5 mt -73.48 -22.98 19.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.811 -0.631 . . . . 45.14 110.357 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -62.04 -34.98 77.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.889 -0.596 . . . . 70.44 110.622 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.561 HD12 HD13 ' B' ' 214' ' ' LEU . 2.5 tm? -72.71 -39.72 66.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.476 -0.564 . . . . 61.13 109.476 176.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.86 95.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.222 0.534 . . . . 71.23 110.23 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 88.7 m-20 -65.26 -23.09 66.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.869 -0.605 . . . . 73.14 110.908 177.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -74.1 -35.8 64.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.102 0.477 . . . . 42.12 110.149 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -81.23 -23.57 37.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.267 0.556 . . . . 54.13 110.137 178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.63 9.37 7.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.495 0.664 . . . . 73.13 110.201 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 26.5 mt-30 -83.81 -5.99 59.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.944 -0.571 . . . . 74.32 110.34 175.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.504 HD22 HG13 ' A' ' 27' ' ' ILE . 1.1 t30 -78.36 109.81 12.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.762 . . . . 62.4 108.941 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 25' ' ' THR . 3.7 t -65.35 -30.2 71.02 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.916 0.71 . . . . 52.23 112.916 -170.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -86.12 -11.73 51.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.761 0.652 . . . . 72.04 112.761 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.504 HG13 HD22 ' A' ' 24' ' ' ASN . 11.0 mt -96.05 144.97 9.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.38 0.61 . . . . 70.42 110.401 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.524 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -79.7 153.64 29.15 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.272 -0.876 . . . . 75.45 109.703 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.4 m -62.63 -20.88 65.22 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.965 -0.561 . . . . 65.24 111.212 -177.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.72 -27.11 72.93 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.903 -0.59 . . . . 63.03 113.73 -177.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 12.0 mm-40 -75.35 -18.96 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.525 0.663 . . . . 63.13 110.262 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -86.46 -43.35 16.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.66 -0.7 . . . . 64.44 110.249 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.408 ' HB3' ' CD1' ' B' ' 243' ' ' TYR . 10.7 p -61.59 -39.26 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.111 -0.495 . . . . 62.22 110.519 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.67 -33.06 75.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.912 -0.585 . . . . 45.14 111.11 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.3 m -69.49 -35.77 75.88 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 43.23 110.059 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.512 ' CD1' HD12 ' B' ' 214' ' ' LEU . 8.1 t80 -67.9 -34.65 77.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.32 0.581 . . . . 74.23 109.509 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.806 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 13.0 ttm -67.0 -51.24 57.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.465 -0.789 . . . . 74.42 111.54 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 30.1 t-105 -60.65 -37.1 80.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.851 0.357 . . . . 73.23 110.584 178.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.56 -37.35 86.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 74.51 111.278 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.52 HD13 ' HB3' ' B' ' 236' ' ' PHE . 47.3 tp -70.01 -32.51 70.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.05 0.452 . . . . 61.01 110.22 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.522 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.45 -42.05 98.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.663 -0.699 . . . . 73.15 110.845 178.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 42' ' ' ARG . 39.5 mtp180 -69.94 -37.31 75.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.096 0.474 . . . . 75.45 110.558 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -74.54 -34.81 63.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.789 -0.641 . . . . 62.22 111.405 -173.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.7 m-20 -74.61 -28.82 61.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.644 0.259 . . . . 54.11 111.495 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.6 -19.25 63.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.554 . . . . 62.11 111.055 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -61.9 -27.88 69.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.128 -0.942 . . . . 73.25 110.738 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.476 ' O ' HG22 ' A' ' 50' ' ' THR . 60.0 m-85 -90.41 10.36 25.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.367 -0.379 . . . . 70.32 111.718 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.508 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.41 -27.16 73.5 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.416 -0.897 . . . . 71.22 111.423 176.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.776 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 26.1 p -67.57 -27.97 67.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 71.12 111.313 -177.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.3 t -90.89 12.83 18.25 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.152 0.501 . . . . 52.21 110.729 -176.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.1 t -78.99 -65.64 0.97 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.248 -0.433 . . . . 65.1 111.534 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.729 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 5.8 m-85 -133.02 -176.05 3.99 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.559 0.578 . . . . 71.33 112.559 -172.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.1 pt-20 -92.62 -48.69 6.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.065 -0.97 . . . . 63.01 111.415 -172.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.487 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.3 p -105.25 156.59 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.244 -0.435 . . . . 60.15 110.065 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.515 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.8 ptmm? -70.52 -25.28 63.05 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.837 -0.345 . . . . 75.25 110.882 -175.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -72.05 -42.21 66.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.084 -0.246 . . . . 71.02 110.917 -178.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.763 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.6 mt-30 -74.15 -45.15 50.53 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 73.04 109.637 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.776 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 17.2 ttt -57.88 -40.68 80.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 72.12 111.684 -179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.541 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.5 tt0 -63.53 -36.59 84.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.95 0.405 . . . . 72.11 111.14 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.77 9.37 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.127 -0.488 . . . . 72.45 111.12 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.763 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 71.5 mmtt -115.21 -1.99 12.82 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-N 116.223 -0.444 . . . . 73.0 110.241 -177.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.478 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.2 ptmt -54.38 -56.5 18.01 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.431 -0.804 . . . . 62.24 110.393 -178.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.478 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.0 tp60 -70.25 -23.17 62.85 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.775 -0.193 . . . . 64.0 110.627 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -71.17 -41.48 70.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.44 -0.345 . . . . 62.02 110.612 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.508 ' SD ' ' HA2' ' A' ' 48' ' ' GLY . 20.2 ptp -81.96 -25.44 34.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.487 0.661 . . . . 71.3 109.309 -179.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.486 ' HG2' HD22 ' B' ' 277' ' ' LEU . 69.3 mtp -82.03 -25.25 34.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.426 -0.806 . . . . 75.14 111.785 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 23.9 t70 -64.23 -33.09 75.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.965 0.412 . . . . 74.32 110.582 -169.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -98.01 -14.28 20.64 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.021 -0.536 . . . . 74.4 110.548 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.439 ' HB2' ' HA ' ' A' ' 66' ' ' MET . 1.0 OUTLIER -57.66 -53.3 59.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 110.08 -0.341 . . . . 65.53 110.08 174.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.783 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -46.98 -58.53 3.87 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.615 -0.72 . . . . 73.43 110.879 174.877 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.595 ' OD1' ' HG2' ' B' ' 270' ' ' MET . 5.7 t0 -91.96 28.44 1.84 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.867 -0.606 . . . . 73.32 111.605 -169.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.446 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 4.6 mtp180 -84.45 -42.39 15.67 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.043 0.449 . . . . 63.33 110.555 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.75 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.0 OUTLIER -87.78 19.58 3.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.258 0.551 . . . . 73.55 109.686 -178.445 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 25.2 tttp -57.11 -66.0 0.53 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.039 -0.982 . . . . 74.31 110.732 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -64.41 -27.23 68.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 64.21 110.949 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.4 mtt -66.3 -38.02 86.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.484 0.659 . . . . 72.41 110.067 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.57 HD22 ' HG2' ' B' ' 266' ' ' MET . 5.4 tt -76.83 -37.37 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.246 -0.888 . . . . 73.21 109.811 -178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.623 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 13.2 t70 -59.55 -41.19 89.56 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.962 -0.563 . . . . 74.41 110.421 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.24 -5.63 33.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.287 -0.87 . . . . 64.21 111.83 -177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -105.67 -4.44 21.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.954 -0.298 . . . . 75.11 111.205 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 51.7 mtt -95.86 -172.87 2.69 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.842 0.353 . . . . 74.12 110.839 175.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.697 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 36.3 mt-10 67.12 -6.5 0.58 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.021 0.928 . . . . 74.33 113.466 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.56 -54.91 38.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.74 0.305 . . . . 51.42 110.783 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -9.12 49.03 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 120.959 0.409 . . . . 61.31 110.179 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.697 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -70.43 -57.03 8.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.869 0.366 . . . . 43.15 110.077 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -68.45 -17.95 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 73.44 110.733 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -109.32 14.56 23.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 60.53 111.487 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -58.68 -51.82 68.32 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.73 0.3 . . . . 74.51 110.296 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.5 t70 . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 116.097 -0.501 . . . . 71.53 110.273 178.269 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 109.71 -0.478 . . . . 74.12 109.71 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -78.34 -81.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.57 -0.286 . . . . 74.31 110.479 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -112.23 -47.06 3.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.896 0.379 . . . . 70.2 110.623 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -80.26 155.84 27.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.031 0.443 . . . . 64.35 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.11 51.93 0.7 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.379 -0.828 . . . . 60.1 112.602 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -56.99 -32.96 66.63 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.976 0.362 . . . . 62.4 111.976 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -81.1 -7.72 59.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.888 0.329 . . . . 62.2 111.888 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -94.1 -62.5 1.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.371 -0.233 . . . . 71.51 110.371 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.725 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.75 -26.34 13.86 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.844 0.683 . . . . 60.13 112.844 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.01 -18.5 65.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.187 -0.205 . . . . 71.21 111.534 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.51 -25.61 22.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.296 0.569 . . . . 52.33 109.573 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.725 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.64 -47.32 69.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 73.21 109.475 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.456 HG13 ' HB1' ' A' ' 39' ' ' ALA . 71.1 mt -66.56 -29.96 48.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.47 -0.786 . . . . 71.51 110.667 178.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -59.14 -36.51 75.36 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.925 -0.58 . . . . 74.1 110.758 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.658 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.5 tm? -68.65 -43.75 75.59 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.432 -0.581 . . . . 70.34 109.432 178.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . 0.404 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -60.2 -40.9 91.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 42.53 110.613 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.577 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 84.8 m-20 -60.36 -30.85 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 71.32 111.199 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -30.05 62.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.338 . . . . 73.01 111.18 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -84.26 -24.33 29.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.584 0.707 . . . . 73.55 109.804 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.63 -9.47 58.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.881 -1.054 . . . . 72.41 110.127 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 25.4 mt-30 -76.99 -6.96 54.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.729 -0.669 . . . . 72.23 111.252 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.584 HD22 HG13 ' B' ' 227' ' ' ILE . 1.6 t30 -72.77 111.86 8.29 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.603 -0.517 . . . . 64.41 109.603 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . 0.434 ' H ' HG22 ' B' ' 225' ' ' THR . 1.8 t -61.78 -35.51 78.36 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.142 0.793 . . . . 71.21 113.142 -171.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.57 -1.22 57.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.589 0.589 . . . . 73.22 112.589 -176.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.584 HG13 HD22 ' B' ' 224' ' ' ASN . 7.0 mt -107.69 153.19 9.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 C-N-CA 120.621 -0.432 . . . . 61.15 110.125 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.685 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 10.4 pt20 -91.99 159.04 15.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.592 -0.521 . . . . 63.4 109.592 177.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 1.1 m -59.67 -26.56 65.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.253 -0.43 . . . . 64.32 111.141 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -65.84 -26.36 72.15 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.629 -0.714 . . . . 62.51 113.695 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.685 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 5.7 mm-40 -78.8 -24.53 44.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.387 0.593 . . . . 71.24 109.615 -178.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . 0.404 HG11 ' O ' ' B' ' 218' ' ' ALA . 26.3 t -82.24 -41.84 18.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.44 -0.8 . . . . 63.43 110.092 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 13.3 p -62.3 -37.35 85.23 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.112 -0.494 . . . . 72.33 110.121 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.04 76.63 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.889 -0.596 . . . . 74.45 110.882 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 42.3 m -68.41 -35.65 77.97 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.855 0.359 . . . . 63.14 110.045 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.578 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.55 -38.01 83.51 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.294 -0.632 . . . . 75.04 109.294 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.75 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -62.13 -53.05 60.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.097 -0.956 . . . . 74.21 110.948 176.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -61.81 -38.67 89.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.125 -0.489 . . . . 74.11 111.114 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.653 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.37 -41.34 96.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.376 -0.374 . . . . 70.14 111.423 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.98 -34.39 78.31 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 120.666 0.27 . . . . 75.11 110.371 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.48 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -62.47 -39.14 92.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.367 -0.379 . . . . 74.21 111.104 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -73.3 -34.94 66.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.146 0.498 . . . . 65.13 110.339 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.408 ' CD1' ' HB3' ' A' ' 33' ' ' SER . 4.3 t80 -80.94 -30.4 35.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.604 -0.725 . . . . 74.35 110.585 -175.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -77.46 -40.59 42.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 72.12 110.824 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -62.35 -17.82 59.9 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.098 0.475 . . . . 72.52 111.274 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -59.32 -26.87 65.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.284 -0.871 . . . . 75.33 111.307 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.429 ' O ' HG22 ' B' ' 250' ' ' THR . 67.4 m-85 -89.6 1.36 56.09 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.373 -0.376 . . . . 72.22 111.511 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -63.72 -29.47 74.83 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.067 -1.063 . . . . 72.31 111.144 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 22.5 m -71.15 -6.97 43.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.102 0.408 . . . . 73.41 112.102 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . 0.429 HG22 ' O ' ' B' ' 247' ' ' PHE . 12.8 t -115.6 16.99 16.46 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.0 0.429 . . . . 43.14 110.623 176.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.2 t -83.97 -59.16 2.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.346 -0.388 . . . . 62.3 110.876 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.723 ' CE2' ' HG2' ' B' ' 261' ' ' LYS . 1.6 m-85 -126.96 172.97 9.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.618 0.247 . . . . 71.52 111.006 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 7.8 pt-20 -94.1 -42.55 8.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.053 -0.522 . . . . 65.11 111.727 -173.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 50.7 p -100.16 154.12 18.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.508 -0.315 . . . . 71.54 110.39 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -65.1 -30.75 71.71 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.9 -0.32 . . . . 71.14 110.595 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -66.85 -45.93 76.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.014 0.435 . . . . 73.41 110.88 -178.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.568 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 22.8 mt-30 -80.19 -24.77 40.08 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.147 -0.479 . . . . 73.41 110.768 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.483 ' SD ' HG12 ' A' ' 85' ' ' ILE . 20.3 ttt -76.34 -39.24 54.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.459 . . . . 70.15 110.214 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.554 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.0 tt0 -67.8 -49.01 64.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.611 . . . . 71.41 111.651 -177.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.26 66.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.128 0.49 . . . . 74.31 110.641 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.723 ' HG2' ' CE2' ' B' ' 252' ' ' PHE . 13.6 mptt -95.89 8.67 42.98 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.47 -0.787 . . . . 33.55 111.487 -175.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.629 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 15.2 ptpt -52.82 -45.74 67.43 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.309 -0.626 . . . . 74.54 109.309 175.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.629 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 10.2 tp60 -75.0 -24.07 58.34 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.99 -0.55 . . . . 72.53 110.858 -175.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.25 -46.31 74.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.571 0.224 . . . . 74.34 110.936 178.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.51 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.7 ptt? -78.4 -33.21 48.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.279 -0.568 . . . . 64.2 109.736 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.623 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 45.8 mtp -83.13 21.65 1.06 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.796 -0.638 . . . . 64.04 111.0 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 34.7 t70 -109.45 -25.08 10.69 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.659 -0.497 . . . . 62.13 109.659 174.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.488 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 18.3 p90 -113.81 -20.62 11.05 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.423 -0.511 . . . . 70.14 111.651 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -54.63 -48.24 72.5 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.097 0.475 . . . . 73.25 110.388 177.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.595 ' HG2' ' OD1' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -53.88 -47.67 70.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.238 -0.892 . . . . 65.42 110.584 175.568 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . 0.482 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 5.4 t70 -78.89 7.11 7.68 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.485 -1.234 . . . . 74.55 111.801 -170.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 6.9 mtp180 -84.02 -26.42 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.918 -0.489 . . . . 71.25 111.669 -171.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.806 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -106.9 15.07 25.84 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.707 -0.397 . . . . 73.1 110.258 179.15 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.446 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 26.3 ttmt -60.78 -53.82 52.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.96 -0.563 . . . . 75.21 110.71 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -64.31 -36.4 84.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.966 0.412 . . . . 61.25 110.801 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.4 mtt -58.91 -43.75 91.12 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 74.32 110.031 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 1.3 tt -72.4 -39.1 68.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.303 -0.862 . . . . 71.23 109.753 -178.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . 0.434 ' N ' ' HE1' ' A' ' 66' ' ' MET . 20.6 t70 -62.19 -34.84 77.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.403 -0.817 . . . . 71.11 111.005 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -83.5 -6.94 59.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.594 -0.73 . . . . 74.13 111.913 -178.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -104.2 -3.77 23.95 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.571 -0.452 . . . . 75.41 111.24 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.447 ' HE3' ' CD2' ' B' ' 277' ' ' LEU . 42.0 mtt -89.82 -167.04 1.74 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.234 -0.439 . . . . 53.41 111.293 176.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.4 mt-10 70.29 -12.25 0.52 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.057 -0.974 . . . . 75.13 113.376 176.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -57.97 -57.76 11.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.051 0.453 . . . . 71.24 110.129 175.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -72.58 -16.24 61.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.043 -0.526 . . . . 65.51 111.475 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' B' ' 282' ' ' GLU . 56.1 mt -76.55 -56.98 6.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.488 -0.323 . . . . 64.34 110.234 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.3 pt-20 -62.18 -34.19 75.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 72.1 110.775 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -87.99 6.56 35.37 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.344 -0.389 . . . . 71.54 111.724 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.515 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 44.2 t80 -56.43 -47.76 78.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.321 -0.622 . . . . 64.42 109.321 174.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 14.6 t70 . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 115.748 -0.66 . . . . 71.51 110.407 176.11 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.9 p-10 . . . . . 0 N--CA 1.453 -0.283 0 N-CA-C 109.81 -0.441 . . . . 51.32 109.81 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.598 ' HB3' ' HE2' ' A' ' 8' ' ' TYR . 37.5 tt0 -65.8 -81.12 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.19 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -124.14 -27.56 3.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.175 0.512 . . . . 73.12 110.24 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -106.38 167.86 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.004 -0.544 . . . . 61.55 111.329 -175.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -78.7 47.18 0.71 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.427 -0.806 . . . . 74.21 111.643 -178.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.598 ' HE2' ' HB3' ' A' ' 4' ' ' GLU . 75.2 m-85 -49.37 -48.54 46.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 71.44 111.591 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -26.27 67.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.041 -0.527 . . . . 23.2 112.2 -175.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.475 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 27.1 mmt180 -81.39 -51.49 8.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.269 -0.172 . . . . 71.11 111.404 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.656 ' HB1' ' HB2' ' B' ' 239' ' ' ALA . . . -63.6 -23.5 67.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.874 0.845 . . . . 70.44 109.701 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -58.63 -33.47 70.08 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.124 -1.398 . . . . 72.31 111.22 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.593 ' HB2' HD11 ' B' ' 217' ' ' LEU . 28.1 mt-10 -79.15 -31.9 44.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.374 0.607 . . . . 75.41 109.469 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.634 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -63.01 -43.46 98.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.019 -0.991 . . . . 75.25 109.533 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.68 HG23 ' HD2' ' B' ' 243' ' ' TYR . 84.9 mt -69.91 -33.09 54.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.348 -0.842 . . . . 72.45 110.598 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -31.14 71.19 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.9 -0.591 . . . . 74.53 111.055 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.548 HD12 HD22 ' B' ' 214' ' ' LEU . 2.8 tm? -69.71 -45.92 67.12 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.05 -0.722 . . . . 72.33 109.05 176.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.77 -39.27 84.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.968 -0.56 . . . . 71.21 110.808 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.91 -21.47 66.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.281 -0.418 . . . . 72.43 111.396 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -33.95 34.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.012 0.435 . . . . 72.5 109.865 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -78.69 -24.3 45.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.245 0.545 . . . . 75.43 110.025 177.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.492 ' OD1' HG23 ' A' ' 29' ' ' THR . 0.2 OUTLIER -70.49 -10.91 60.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.49 -0.777 . . . . 65.53 109.577 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -78.83 -9.75 59.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.584 -0.734 . . . . 75.12 110.737 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.463 HD22 HG13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -70.43 159.64 33.84 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.154 0.502 . . . . 64.34 110.977 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.6 t -121.37 -16.57 7.84 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.469 -0.787 . . . . 72.1 110.239 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.74 3.71 49.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.515 -0.766 . . . . 74.0 111.021 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.726 HG22 ' H ' ' A' ' 28' ' ' GLN . 1.6 mt -128.25 -174.72 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.13 109.742 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.843 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 41.5 mt-30 -120.4 160.57 22.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.389 -0.597 . . . . 45.23 109.389 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.519 HG22 ' HZ ' ' B' ' 247' ' ' PHE . 58.6 m -64.01 -38.56 91.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.024 0.44 . . . . 73.45 110.802 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.56 74.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.086 -0.578 . . . . 71.45 112.979 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.843 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 8.5 mm-40 -68.99 -35.76 77.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.312 0.577 . . . . 64.33 109.596 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.41 HG21 ' HA ' ' A' ' 22' ' ' ASN . 47.8 t -63.84 -43.97 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.176 -0.92 . . . . 71.4 109.819 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.1 t -61.08 -42.93 99.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.719 -0.673 . . . . 73.4 110.438 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.888 -0.596 . . . . 61.34 111.279 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.518 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 16.2 m -66.71 -33.13 74.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.775 -0.454 . . . . 71.12 109.775 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.647 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.0 t80 -67.11 -41.09 86.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.3 0.572 . . . . 72.23 109.538 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.72 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.0 ttm -64.65 -48.47 74.7 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.51 -0.768 . . . . 75.12 111.427 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.517 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 27.4 t-105 -64.21 -37.15 86.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.387 . . . . 74.34 110.916 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.581 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -65.44 -36.38 83.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.962 0.41 . . . . 33.54 110.657 178.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.756 HD21 ' SD ' ' B' ' 237' ' ' MET . 58.6 tp -68.52 -36.96 79.58 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 74.42 109.703 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -33.25 71.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.644 -0.707 . . . . 65.31 111.076 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -78.5 -52.51 8.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.13 -0.486 . . . . 74.12 110.733 178.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.445 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 20.2 t80 -65.42 -42.28 92.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.39 -0.823 . . . . 74.23 111.549 -173.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -80.24 -25.14 39.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.405 -0.362 . . . . 64.31 111.652 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.616 ' HB2' ' HG ' ' B' ' 277' ' ' LEU . . . -81.28 -21.03 39.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.081 0.467 . . . . 74.12 110.54 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.445 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 11.3 t90 -56.63 -32.92 65.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 71.13 110.553 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -72.51 -9.0 58.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 71.2 111.532 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.79 -30.92 74.86 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.468 -0.872 . . . . 70.13 111.066 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 t -71.62 -2.96 18.99 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.747 0.308 . . . . 43.14 111.212 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -127.25 16.18 7.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.194 0.521 . . . . 53.34 109.978 174.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.5 t -74.17 -47.9 32.74 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.943 -0.571 . . . . 70.13 111.203 -175.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.643 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -134.03 -176.09 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.126 0.489 . . . . 74.21 112.078 -176.48 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.643 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.2 pt-20 -97.63 -25.59 15.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.133 -0.939 . . . . 75.51 111.881 -171.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.536 ' HA ' ' CE2' ' B' ' 288' ' ' PHE . 67.7 p -135.92 157.76 46.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.199 -0.455 . . . . 73.11 109.785 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.561 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 9.8 ptmm? -71.64 -30.59 65.93 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.547 -0.461 . . . . 72.04 110.322 -177.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.74 -38.78 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 61.2 110.414 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.697 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 23.0 mt-30 -88.05 -38.14 15.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.74 -0.664 . . . . 63.22 110.265 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.5 ttt -60.07 -40.86 91.01 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.144 0.497 . . . . 72.52 111.182 178.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -63.37 -31.39 72.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.607 -0.724 . . . . 62.24 110.823 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.78 1.89 47.79 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.044 -0.525 . . . . 64.31 111.07 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -111.9 -0.99 15.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.092 -0.504 . . . . 71.23 109.715 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 8.3 ttmm -51.39 -62.7 1.46 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.413 -0.812 . . . . 72.53 110.285 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -75.64 -11.92 60.1 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.548 -0.751 . . . . 63.21 110.471 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.42 -49.89 17.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.668 . . . . 73.12 110.767 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.507 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.2 ptt? -79.76 -26.7 40.61 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.253 0.549 . . . . 75.43 109.846 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.444 ' HG2' HD22 ' B' ' 277' ' ' LEU . 92.4 mtp -79.14 -2.12 39.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.641 -0.709 . . . . 72.13 110.522 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -74.47 -27.57 60.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.418 -0.956 . . . . 61.3 108.418 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.462 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 26.5 m-85 -102.82 -30.12 11.04 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.111 -1.404 . . . . 75.35 111.995 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -56.28 -58.31 8.52 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.011 -0.737 . . . . 73.22 109.011 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.523 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -56.9 -59.53 4.9 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.499 -0.318 . . . . 75.12 110.992 173.31 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -107.42 75.59 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.703 0.631 . . . . 73.13 112.703 -170.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.462 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 2.1 mmm180 -140.52 -29.95 0.67 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.841 -0.618 . . . . 74.34 110.323 166.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.05 7.42 24.69 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.727 -0.842 . . . . 71.2 108.727 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -59.59 -60.22 4.19 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.732 -1.122 . . . . 62.11 110.417 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.31 -32.39 73.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.89 -0.595 . . . . 73.01 111.517 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.465 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 53.0 mtt -59.76 -48.92 79.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.556 0.693 . . . . 72.11 109.321 172.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.737 HD21 ' HD2' ' B' ' 269' ' ' TYR . 17.6 tp -63.32 -38.27 90.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.416 -1.266 . . . . 74.12 110.628 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.406 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -63.19 -53.93 45.48 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.771 -0.65 . . . . 64.13 110.199 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.12 -12.92 61.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.064 -0.971 . . . . 65.22 111.604 -178.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.0 -10.26 39.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.383 -0.371 . . . . 64.31 110.939 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.46 ' O ' HG13 ' A' ' 85' ' ' ILE . 63.4 mtt -101.12 -55.28 2.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 72.21 111.246 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.582 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 11.5 pt-20 -68.64 -14.89 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.852 0.686 . . . . 73.45 112.852 -169.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.09 -33.27 70.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.445 -0.576 . . . . 62.2 109.445 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -77.23 -38.41 51.28 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.859 -0.61 . . . . 75.34 110.215 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.647 HD13 ' HA ' ' B' ' 259' ' ' GLN . 68.1 mt -59.22 -54.84 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.854 -0.612 . . . . 72.41 110.932 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.829 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 8.4 pt-20 -58.82 -33.87 70.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.454 -0.339 . . . . 70.31 111.559 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -94.24 17.51 12.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.681 -0.236 . . . . 64.52 111.497 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.494 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 22.2 t80 -53.14 -51.69 61.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.707 -0.224 . . . . 74.41 110.996 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.246 -0.434 . . . . 75.14 111.27 -179.587 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.3 p-10 . . . . . 0 N--CA 1.45 -0.437 0 N-CA-C 109.053 -0.721 . . . . 74.43 109.053 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.46 -92.51 0.12 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.88 0.371 . . . . 73.52 110.975 -176.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -95.4 -28.75 14.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.437 0.637 . . . . 71.1 109.483 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -103.87 160.58 14.68 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.26 -0.882 . . . . 70.41 110.882 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.518 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -82.06 48.34 1.23 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.978 -1.01 . . . . 63.12 111.617 -177.641 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.517 ' HD2' ' HA ' ' B' ' 203' ' ' ASN . 53.7 m-85 -46.98 -53.55 12.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.242 -0.435 . . . . 75.1 111.921 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -58.88 -36.4 74.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.897 -0.592 . . . . 61.12 112.247 -176.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.483 ' O ' HD23 ' B' ' 214' ' ' LEU . 35.7 mmt180 -71.63 -48.94 44.58 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 111.75 0.278 . . . . 61.24 111.75 -176.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 39' ' ' ALA . . . -63.88 -26.54 68.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.951 0.882 . . . . 75.43 109.585 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . 0.416 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 3.1 m -62.54 -32.73 73.73 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.254 -1.339 . . . . 70.11 111.611 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 32.8 mt-10 -75.35 -28.75 59.71 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.553 0.692 . . . . 72.45 109.247 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.647 HD12 ' CD1' ' A' ' 36' ' ' PHE . 3.4 mm? -65.37 -44.39 87.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.996 -1.002 . . . . 75.33 109.578 176.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.435 HG23 ' HD2' ' A' ' 43' ' ' TYR . 75.2 mt -69.15 -27.93 36.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.441 -0.799 . . . . 73.15 110.389 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 14.2 tmtt? -60.15 -35.09 74.53 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.079 -0.51 . . . . 61.22 110.931 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.0 tm? -69.77 -42.25 74.07 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.968 -0.753 . . . . 74.13 108.968 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.33 84.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.84 -0.618 . . . . 74.01 110.797 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 93.6 m-20 -60.61 -26.11 66.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 72.22 111.165 179.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -31.85 43.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.594 -0.276 . . . . 72.44 111.2 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -80.69 -28.06 36.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.479 0.656 . . . . 71.11 110.594 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -75.44 -1.47 24.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.185 -0.916 . . . . 71.12 110.672 -178.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.9 mm-40 -79.28 -0.56 32.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.06 -0.518 . . . . 73.31 111.613 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 1.0 HD22 HG13 ' B' ' 227' ' ' ILE . 43.2 t30 -80.06 164.9 23.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.015 0.436 . . . . 63.21 110.49 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 1.5 t -96.18 -40.11 9.35 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.82 -0.627 . . . . 50.33 112.468 -173.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.16 3.18 43.64 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 112.91 0.707 . . . . 75.24 112.91 -175.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 1.0 HG13 HD22 ' B' ' 224' ' ' ASN . 12.7 mt -94.88 147.41 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 C-N-CA 120.192 -0.603 . . . . 71.42 109.565 175.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.577 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 37.2 mt-30 -84.01 147.37 27.46 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.569 -0.741 . . . . 73.41 109.365 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 7.8 m -57.3 -27.43 62.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.277 0.561 . . . . 54.14 110.282 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -76.65 -21.16 75.4 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.577 -0.738 . . . . 60.35 113.41 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.577 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 12.4 mm-40 -72.29 -30.98 65.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.64 0.72 . . . . 60.25 110.088 -176.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.3 t -69.73 -39.85 78.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.293 -0.867 . . . . 72.21 109.502 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.9 t -62.56 -38.49 90.29 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.78 -0.645 . . . . 61.14 109.744 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.27 -36.33 82.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.949 -0.568 . . . . 71.42 110.796 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.475 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.2 m -66.44 -35.21 79.74 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.686 -0.487 . . . . 73.13 109.686 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.558 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.0 t80 -66.96 -37.57 84.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.774 -0.648 . . . . 74.55 109.655 176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.756 ' SD ' HD21 ' A' ' 40' ' ' LEU . 8.6 tpt -63.64 -52.45 60.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 75.34 110.729 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.465 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 22.3 t-105 -63.48 -38.41 91.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.96 -0.564 . . . . 74.41 111.332 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.656 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -65.72 -31.85 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.547 -0.297 . . . . 60.41 111.392 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' B' ' 244' ' ' ASN . 44.4 tp -64.85 -38.52 91.27 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.864 -0.421 . . . . 62.11 109.864 177.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.543 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 71.21 110.312 177.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . 0.409 ' NE ' ' HA ' ' B' ' 242' ' ' ARG . 1.0 OUTLIER -58.68 -48.86 79.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 75.22 111.53 178.022 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.68 ' HD2' HG23 ' A' ' 15' ' ' ILE . 11.3 t80 -75.33 -36.85 60.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.968 -0.56 . . . . 73.34 111.494 -173.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' B' ' 240' ' ' LEU . 9.0 t-20 -74.88 -40.52 60.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.835 0.35 . . . . 74.11 111.266 -176.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.426 ' HB2' HD12 ' A' ' 77' ' ' LEU . . . -66.82 -22.47 66.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.932 0.396 . . . . 62.23 111.272 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' B' ' 243' ' ' TYR . 13.2 t90 -57.56 -31.81 66.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.606 -0.724 . . . . 63.34 110.565 175.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.519 ' HZ ' HG22 ' A' ' 29' ' ' THR . 71.3 m-85 -74.79 -11.03 60.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.238 -0.437 . . . . 73.02 111.526 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -70.13 -31.35 69.27 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.477 -0.868 . . . . 55.34 111.186 175.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . 0.86 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 22.6 t -74.15 -7.84 54.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.807 0.337 . . . . 70.35 110.942 -176.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -120.86 21.59 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.354 0.597 . . . . 71.22 109.613 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 7.2 t -91.0 -38.69 12.66 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.691 -0.686 . . . . 62.2 111.289 -175.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.617 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -138.0 -170.07 2.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.204 0.526 . . . . 75.52 111.955 -176.888 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' B' ' 254' ' ' THR . 14.7 pt-20 -100.38 -49.82 4.12 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.349 -0.842 . . . . 73.33 111.237 -176.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.414 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 70.4 p -111.28 155.98 22.2 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.521 -0.309 . . . . 42.33 110.391 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.829 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 5.9 ptmm? -68.29 -27.26 66.16 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.812 -0.355 . . . . 62.32 110.588 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.25 -53.86 53.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.135 0.493 . . . . 71.32 110.327 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.692 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 14.4 mt-30 -79.1 -36.01 41.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.717 -0.674 . . . . 73.31 110.372 -177.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.86 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 20.4 ttt -61.9 -40.04 94.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.747 -0.661 . . . . 53.15 111.047 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.647 ' HA ' HD13 ' A' ' 85' ' ' ILE . 4.8 tp-100 -59.98 -41.57 92.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.957 -0.565 . . . . 70.11 110.823 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.99 -17.29 62.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.777 -0.647 . . . . 71.31 111.064 -178.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.692 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.3 mmmt -91.58 -18.16 24.5 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 116.118 -0.492 . . . . 72.23 110.523 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -48.41 -61.64 1.91 Allowed 'General case' 0 N--CA 1.443 -0.818 0 O-C-N 123.709 0.63 . . . . 53.41 110.439 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.01 -26.02 65.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.004 -0.544 . . . . 73.13 111.021 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -74.26 -35.94 63.81 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.988 -0.285 . . . . 75.22 111.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 19.0 ptp -83.65 -25.32 30.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.104 -0.702 . . . . 61.41 109.104 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.406 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 58.9 mtp -80.7 -24.67 38.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.16 -0.927 . . . . 73.41 111.784 179.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.18 -35.69 71.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.909 0.385 . . . . 62.43 111.93 -168.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.59 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 25.2 p90 -103.33 -3.41 25.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.291 -0.413 . . . . 70.14 110.903 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.737 ' HD2' HD21 ' A' ' 77' ' ' LEU . 2.1 m-30 -65.84 -42.72 90.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.452 0.168 . . . . 75.41 111.115 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -44.62 83.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.538 0.685 . . . . 74.2 109.577 174.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -86.06 17.39 3.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.98 -1.009 . . . . 73.35 111.621 -172.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.59 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 2.0 mmm180 -89.61 -47.88 7.67 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.501 -0.749 . . . . 64.45 110.94 -174.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.72 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.22 12.23 33.63 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.099 0.476 . . . . 72.24 109.796 -176.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -58.43 -57.98 10.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.41 -0.814 . . . . 63.23 110.341 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -60.76 -37.99 83.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.723 -0.671 . . . . 64.2 111.111 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 48.9 mtt -59.59 -45.55 91.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.433 0.635 . . . . 55.33 110.092 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.616 ' HG ' ' HB2' ' A' ' 45' ' ' ALA . 6.3 tt -71.56 -42.1 68.26 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.175 -0.92 . . . . 71.33 110.413 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -56.8 -41.98 78.68 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.468 0.651 . . . . 71.45 110.301 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.06 -13.32 62.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.902 -1.044 . . . . 73.13 112.189 -177.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -98.9 -7.95 26.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.987 0.422 . . . . 75.21 110.391 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.523 ' HG3' ' HB1' ' A' ' 45' ' ' ALA . 55.1 mtt -94.19 -50.77 5.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.221 -0.445 . . . . 74.02 111.08 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 0.0 OUTLIER -57.13 -25.8 59.45 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.49 -0.777 . . . . 72.22 111.968 -173.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.56 -42.57 92.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.055 -0.52 . . . . 64.02 110.448 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -82.36 -34.47 28.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 71.45 110.516 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.448 HG13 ' O ' ' B' ' 281' ' ' MET . 69.0 mt -58.22 -58.02 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 116.228 -0.442 . . . . 74.11 111.677 -177.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.0 pt-20 -64.49 -29.06 70.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.34 -0.391 . . . . 74.12 111.346 -175.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -100.04 12.45 36.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.721 -0.218 . . . . 64.53 111.342 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.561 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 78.3 t80 -55.31 -56.94 14.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.727 -0.215 . . . . 60.52 111.19 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 22.9 t70 . . . . . 0 C--N 1.328 -0.35 0 CA-C-O 120.82 0.343 . . . . 71.33 110.598 -176.836 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.7 p-10 . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 109.483 -0.562 . . . . 62.32 109.483 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -67.99 -83.4 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.438 . . . . 75.11 111.0 -176.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -111.9 -42.16 3.85 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.854 -0.612 . . . . 71.41 109.511 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.709 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -93.45 154.02 18.16 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.859 -0.61 . . . . 75.4 110.097 174.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.452 ' HB2' ' HD2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -78.36 51.91 1.08 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.602 -0.726 . . . . 74.11 112.478 -177.333 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -51.91 -46.95 64.81 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.847 0.356 . . . . 72.02 111.46 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.2 -6.07 36.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.913 -0.585 . . . . 75.43 112.359 -173.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 84.7 mtt180 -100.11 -60.71 1.48 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.926 -0.398 . . . . 73.23 109.926 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.27 -25.65 24.63 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.594 0.59 . . . . 52.53 112.594 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.9 t -62.13 -26.53 68.37 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.743 -0.208 . . . . 73.05 111.362 -178.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.565 ' HB2' HD11 ' B' ' 217' ' ' LEU . 26.5 mt-10 -84.39 -25.14 29.3 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.354 0.597 . . . . 75.25 109.705 -178.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.74 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -68.56 -49.53 58.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.31 -0.859 . . . . 71.5 109.203 177.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.525 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.2 mt -64.91 -29.28 46.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.643 -0.708 . . . . 71.34 109.807 175.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 12' ' ' THR . 2.4 tmmt? -62.5 -38.0 88.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.804 -0.634 . . . . 74.22 111.085 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.5 HD12 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -65.92 -47.42 74.83 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.873 -0.788 . . . . 54.04 108.873 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.59 -35.85 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.39 -0.823 . . . . 70.13 110.969 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.627 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 5.1 m-80 -58.94 -34.5 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 75.11 111.347 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.0 -41.58 67.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.242 -0.435 . . . . 72.23 111.271 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -74.11 -20.51 60.23 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.346 0.593 . . . . 73.14 109.909 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.603 HD21 HG23 ' A' ' 29' ' ' THR . 2.9 t-20 -83.51 -4.91 58.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.302 -0.863 . . . . 74.44 110.751 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.627 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 26.4 mt-30 -82.54 17.83 1.67 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.396 -0.365 . . . . 72.45 111.162 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.849 HD22 HG13 ' A' ' 27' ' ' ILE . 18.6 t30 -105.33 156.96 17.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.759 0.314 . . . . 72.4 110.616 -177.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 t -100.63 -37.02 8.94 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.837 0.68 . . . . 72.44 112.837 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.8 pm0 -85.23 -2.44 58.05 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.752 -0.379 . . . . 72.42 110.951 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.849 HG13 HD22 ' A' ' 24' ' ' ASN . 8.6 mt -96.91 145.44 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.526 0.679 . . . . 64.34 110.252 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.653 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 9.0 mt-30 -79.66 140.71 36.97 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.716 -1.129 . . . . 65.42 108.105 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.603 HG23 HD21 ' A' ' 22' ' ' ASN . 17.4 m -58.38 -24.83 61.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.987 0.422 . . . . 72.21 111.06 -176.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -82.17 -11.73 81.9 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.868 -0.605 . . . . 73.05 113.833 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.653 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 50.2 mt-10 -70.21 -31.31 68.68 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 117.97 0.885 . . . . 70.45 110.286 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 19.0 t -79.45 -32.76 14.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.642 -0.708 . . . . 64.11 109.901 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.66 -42.57 98.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.608 -0.723 . . . . 72.31 110.202 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.04 -36.22 81.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.624 -0.716 . . . . 73.54 111.177 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.452 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 3.6 p -71.96 -27.71 62.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.35 110.458 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.593 ' CD1' HD12 ' B' ' 214' ' ' LEU . 11.4 t80 -69.6 -37.57 76.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.415 -0.587 . . . . 72.21 109.415 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.751 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 12.1 ttt -72.73 -49.85 28.4 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.892 -0.595 . . . . 74.14 111.104 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -52.4 -41.66 63.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.497 -0.774 . . . . 75.55 110.831 174.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.542 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.97 -33.78 76.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 63.13 111.348 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.562 HD21 ' HG3' ' B' ' 237' ' ' MET . 58.3 tp -65.65 -35.64 81.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.024 0.44 . . . . 71.02 110.136 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.446 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -63.4 -44.26 95.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.783 -0.644 . . . . 72.4 110.715 178.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -67.21 -24.12 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.215 -0.448 . . . . 61.44 110.99 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.411 ' HD1' HG23 ' B' ' 215' ' ' ILE . 3.1 t80 -90.02 -47.43 7.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.29 -0.414 . . . . 65.12 110.836 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -65.44 -26.04 67.79 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.1 0.407 . . . . 73.13 112.1 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.43 -14.53 62.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.787 0.327 . . . . 65.22 111.259 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -61.58 -31.92 72.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 75.05 110.342 176.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.882 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 55.0 m-85 -70.65 -12.99 61.9 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.173 -0.467 . . . . 71.42 111.226 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.505 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -65.54 -32.63 83.91 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.22 -0.991 . . . . 52.34 110.643 173.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.903 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 15.3 m -78.23 -9.57 59.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.009 0.433 . . . . 30.52 110.857 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 63.2 p -106.71 -3.1 20.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.184 0.516 . . . . 55.31 110.324 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.1 t -72.84 -43.37 62.73 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.67 -0.696 . . . . 75.03 110.522 -175.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.47 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 11.0 m-85 -149.72 178.1 9.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.921 -0.582 . . . . 71.14 110.596 -177.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.6 pt-20 -98.61 -52.65 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.059 -0.519 . . . . 60.13 111.129 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.425 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.6 p -88.01 148.59 24.45 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 116.596 -0.275 . . . . 72.43 110.523 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.427 ' HB2' ' HE2' ' A' ' 55' ' ' LYS . 7.8 ptmm? -66.28 -25.34 66.82 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.869 -0.332 . . . . 75.11 110.62 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -64.59 -41.65 96.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.437 . . . . 71.51 110.613 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.725 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.6 mt-30 -85.93 -37.99 18.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.996 -0.547 . . . . 71.35 109.806 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.903 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.6 ttt -63.88 -43.43 96.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.586 -0.734 . . . . 63.33 111.618 -177.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.575 ' HA ' HD13 ' B' ' 285' ' ' ILE . 42.9 tt0 -68.86 -34.92 76.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.36 -0.382 . . . . 75.53 111.154 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.07 2.56 10.35 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.205 -0.452 . . . . 73.14 111.613 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.725 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.6 mmmt -113.52 -2.44 13.87 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 110.092 -0.336 . . . . 63.13 110.092 -177.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 0.2 OUTLIER -49.74 -57.9 6.38 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 123.721 0.638 . . . . 75.42 110.889 -175.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -80.07 -20.96 43.98 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 110.254 -0.276 . . . . 74.24 110.254 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -73.53 -39.61 64.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 63.42 111.866 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.5 ptt? -84.32 -19.12 34.24 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 119.9 -0.72 . . . . 60.3 109.483 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.402 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 46.0 mtp -85.35 -21.85 28.72 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.276 -0.874 . . . . 73.02 111.35 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.114 0.483 . . . . 53.3 111.072 -171.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.595 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.6 p90 -96.99 -8.12 31.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.863 -0.608 . . . . 75.24 111.073 -178.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.524 ' HD2' HD21 ' B' ' 277' ' ' LEU . 2.6 m-30 -61.4 -40.16 93.38 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 120.576 0.227 . . . . 72.35 111.009 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.617 ' SD ' ' HE3' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -55.69 -50.75 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.323 0.582 . . . . 73.11 110.224 174.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.539 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 1.9 t70 -88.02 27.45 1.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.238 -0.892 . . . . 71.2 111.467 -170.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 17.3 mmm180 -91.95 -54.45 3.85 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.17 -0.331 . . . . 61.44 111.317 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.748 ' HB3' ' HG2' ' B' ' 237' ' ' MET . 0.1 OUTLIER -79.33 5.62 12.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.181 0.515 . . . . 71.21 110.527 -177.372 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.74 -45.93 92.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.501 -0.772 . . . . 73.4 110.684 -179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.51 -33.11 74.96 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.726 -0.67 . . . . 72.35 111.097 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -69.2 -41.1 77.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.341 0.591 . . . . 64.53 109.951 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.49 ' HB3' ' CE ' ' B' ' 266' ' ' MET . 0.7 OUTLIER -65.36 -38.84 91.26 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.906 -1.043 . . . . 74.23 111.423 -174.539 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.445 ' N ' ' HE1' ' B' ' 266' ' ' MET . 28.8 t70 -65.21 -33.56 76.29 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.1 0.476 . . . . 52.12 110.795 -178.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.96 -14.84 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.895 -0.593 . . . . 73.35 110.753 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -92.22 -20.39 21.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.555 . . . . 71.44 110.383 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.44 ' C ' ' H ' ' A' ' 83' ' ' ASP . 24.0 mmt -77.2 -168.26 1.07 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.935 -0.575 . . . . 54.34 110.936 177.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 1.051 ' HA ' HD12 ' A' ' 85' ' ' ILE . 48.6 mt-10 66.98 -7.69 0.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.994 -1.003 . . . . 72.13 112.201 -178.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.468 ' O ' HG13 ' A' ' 85' ' ' ILE . 41.8 t0 -79.15 150.61 31.67 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.732 -0.84 . . . . 75.51 108.732 172.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.467 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 3.1 m-85 73.13 -40.92 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.589 1.155 . . . . 73.32 110.672 -172.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 1.051 HD12 ' HA ' ' A' ' 82' ' ' GLU . 7.4 mt -56.72 -57.63 8.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.269 -0.878 . . . . 73.32 111.131 177.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.479 ' HG3' ' ND2' ' A' ' 87' ' ' ASN . 7.9 pt-20 -57.75 -26.54 61.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.172 -0.922 . . . . 70.32 111.356 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.479 ' ND2' ' HG3' ' A' ' 86' ' ' GLU . 56.6 m-80 -100.43 2.82 42.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.41 111.47 -175.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -58.72 -48.22 81.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 72.33 110.452 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.079 -0.51 . . . . 74.33 110.334 178.666 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 . . . . . 0 CA--C 1.521 -0.147 0 CA-C-O 120.917 0.389 . . . . 72.44 111.056 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.62 -86.51 0.15 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.997 -0.547 . . . . 63.15 110.321 173.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -111.6 -24.83 9.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.063 0.459 . . . . 62.12 110.546 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -94.76 -160.41 0.78 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.942 -0.572 . . . . 63.24 111.608 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.452 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -127.29 44.47 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.649 -0.705 . . . . 72.4 110.907 -176.575 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -52.89 -49.11 66.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.936 -0.575 . . . . 74.44 111.927 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.99 -25.57 63.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.82 -0.627 . . . . 65.33 112.027 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -82.64 -60.64 2.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 110.184 -0.302 . . . . 73.52 110.184 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.602 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -56.69 -27.29 58.6 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.872 0.693 . . . . 72.23 112.872 -176.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.1 t -68.59 -20.16 64.5 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.851 0.358 . . . . 73.23 110.976 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -80.81 -31.5 35.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.479 0.657 . . . . 75.15 109.283 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -66.4 -50.58 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.867 -1.06 . . . . 72.2 110.017 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.542 HG13 ' HB1' ' A' ' 39' ' ' ALA . 75.0 mt -63.82 -32.05 55.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.878 -0.601 . . . . 71.51 110.373 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -60.11 -34.09 73.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.462 -0.79 . . . . 71.44 110.985 -177.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.649 HD12 HD13 ' A' ' 14' ' ' LEU . 3.3 tm? -69.7 -40.42 76.34 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.288 -0.634 . . . . 64.31 109.288 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -63.06 -31.83 73.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.014 -0.539 . . . . 73.31 110.674 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.74 -31.62 72.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 73.23 110.76 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.11 -18.05 53.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.114 -0.494 . . . . 63.13 111.131 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . 0.408 ' OE1' HD21 ' A' ' 14' ' ' LEU . 70.5 mt-30 -92.38 -25.04 18.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.232 0.539 . . . . 62.51 110.021 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . 0.405 HD22 ' HA ' ' B' ' 222' ' ' ASN . 3.0 t-20 -79.14 4.46 14.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.753 -0.658 . . . . 65.24 109.968 177.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -73.47 -10.68 59.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.012 -0.736 . . . . 75.11 109.012 172.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.69 HD22 ' HG2' ' B' ' 226' ' ' GLU . 2.7 m120 -77.78 134.87 37.95 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.078 -0.964 . . . . 62.43 110.855 175.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.5 t -115.35 -15.63 11.54 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.397 -0.819 . . . . 73.04 108.823 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . 0.69 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.6 pm0 -76.52 -22.76 53.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.969 -1.014 . . . . 75.51 110.423 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.406 HG22 ' N ' ' B' ' 228' ' ' GLN . 10.0 mt -98.29 156.37 3.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.269 -0.423 . . . . 73.32 109.941 177.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.546 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 11.7 mt-30 -76.01 138.88 41.19 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.519 -0.548 . . . . 74.4 109.519 174.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 26.9 m -60.14 -29.72 68.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.532 . . . . 64.31 110.436 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . 0.882 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -63.93 -26.8 70.45 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 115.62 -0.718 . . . . 43.32 113.048 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.546 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 34.5 mt-10 -72.8 -31.19 64.67 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 117.233 0.517 . . . . 72.55 110.468 -177.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 43.7 t -73.3 -36.9 50.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.355 0.597 . . . . 75.41 110.265 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 5.9 t -72.36 -37.75 68.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.957 -0.565 . . . . 54.3 109.73 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.36 -33.05 73.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.822 -0.627 . . . . 62.42 111.383 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 3.5 p -69.52 -28.79 66.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.795 0.331 . . . . 62.52 110.456 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.586 ' CD1' HD12 ' A' ' 14' ' ' LEU . 7.7 t80 -69.77 -37.07 76.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.536 0.684 . . . . 61.03 109.17 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.748 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 11.1 ttt -71.76 -52.91 15.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.451 -0.795 . . . . 62.11 111.251 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 14.1 t-105 -52.35 -39.9 61.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.49 -0.777 . . . . 75.01 111.061 175.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.525 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.43 -36.76 84.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 75.45 111.126 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 57.7 tp -65.82 -35.18 79.97 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.864 0.364 . . . . 64.34 110.33 179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.77 73.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 64.43 110.781 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -64.66 -33.59 76.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.099 -0.501 . . . . 72.14 110.84 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -74.36 -39.55 62.69 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.947 -0.569 . . . . 73.43 111.021 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.13 -24.1 51.69 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.936 0.347 . . . . 71.3 111.936 -178.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.403 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.19 -17.48 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 71.32 111.089 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -59.0 -38.11 78.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.851 -0.613 . . . . 73.31 110.251 175.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -75.81 3.22 10.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.625 -0.716 . . . . 73.14 111.82 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . 0.508 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -65.39 -35.01 90.88 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 119.983 -1.103 . . . . 72.44 110.438 171.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . 0.923 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 78.9 p -77.66 -6.67 54.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.285 -0.458 . . . . 64.23 111.362 -177.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 62.4 p -109.38 -1.94 18.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.085 0.469 . . . . 70.14 110.408 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 24.0 t -81.44 -39.8 24.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.721 -0.672 . . . . 72.53 110.771 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.68 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 1.7 m-85 -145.13 178.71 7.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.132 0.492 . . . . 73.43 112.075 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.471 ' HG3' HG23 ' B' ' 254' ' ' THR . 13.5 pt-20 -104.5 -43.91 5.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.269 -0.878 . . . . 74.23 111.516 -172.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.471 HG23 ' HG3' ' B' ' 253' ' ' GLU . 45.7 p -104.77 149.4 25.66 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 116.523 -0.308 . . . . 64.41 110.287 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.418 ' HB2' ' HE2' ' B' ' 255' ' ' LYS . 10.5 ptmm? -69.62 -26.83 64.62 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.846 0.355 . . . . 73.11 110.218 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -53.01 -51.35 61.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.64 -0.709 . . . . 71.53 110.579 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.599 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.0 mt-30 -83.7 -46.69 12.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.561 -0.745 . . . . 71.14 110.344 -178.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.923 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.6 ttt -56.35 -41.74 76.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.458 -0.792 . . . . 63.45 111.829 -175.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.63 ' HB2' HG21 ' A' ' 85' ' ' ILE . 28.7 tt0 -69.59 -36.41 76.2 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.673 0.273 . . . . 71.54 110.989 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.68 -6.22 51.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.345 0.593 . . . . 55.42 110.495 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.68 ' HE3' ' CE2' ' B' ' 252' ' ' PHE . 70.6 mmtt -99.03 -2.33 37.48 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.531 -0.759 . . . . 71.15 110.944 -177.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.699 ' HG3' ' H ' ' B' ' 263' ' ' GLN . 11.6 ptpt -50.73 -50.77 54.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.853 -0.612 . . . . 71.2 110.546 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.699 ' H ' ' HG3' ' B' ' 262' ' ' LYS . 12.5 tp60 -79.47 -22.14 44.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 116.145 -0.48 . . . . 72.04 110.533 -176.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.55 -30.8 37.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.239 -0.437 . . . . 55.05 111.408 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.508 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 24.0 ptp -83.75 -31.49 25.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.648 -0.871 . . . . 70.21 108.648 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.49 ' CE ' ' HB3' ' A' ' 77' ' ' LEU . 59.2 mtp -82.64 -3.37 56.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.259 -0.882 . . . . 64.42 110.442 176.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.44 -42.73 98.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.132 -0.486 . . . . 74.25 110.629 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.662 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 21.0 p90 -105.63 -9.04 17.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.865 -0.607 . . . . 70.12 111.079 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 3.5 m-30 -55.41 -51.13 67.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 O-C-N 123.074 0.233 . . . . 72.42 110.785 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.545 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -50.44 -58.5 5.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.893 -0.594 . . . . 74.01 110.74 176.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . 0.471 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 19.6 t70 -87.2 63.69 7.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.658 -0.701 . . . . 72.42 111.108 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 4.9 mmp_? -121.97 -45.66 2.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.111 -0.495 . . . . 64.34 111.284 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.751 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -92.03 13.28 19.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.3 . . . . 74.04 110.515 -174.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.617 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.0 ttmt -59.3 -54.31 48.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 53.11 110.84 -178.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -59.97 -41.56 92.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.397 -0.365 . . . . 64.52 111.41 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.18 -47.97 83.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.385 0.612 . . . . 71.24 109.963 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.574 HD23 ' HE1' ' A' ' 70' ' ' MET . 41.5 tp -63.18 -36.65 84.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.875 -1.057 . . . . 74.5 110.504 -178.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . 0.402 ' N ' ' HE1' ' A' ' 66' ' ' MET . 9.1 t70 -63.71 -42.08 98.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.73 -0.668 . . . . 70.14 110.458 177.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -76.33 -14.99 60.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.649 -0.705 . . . . 42.21 111.324 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -94.85 -2.82 50.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.061 0.457 . . . . 74.24 110.72 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 19.0 mmt -89.49 179.77 5.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.883 -0.599 . . . . 73.44 110.684 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.704 ' HG2' HD12 ' B' ' 285' ' ' ILE . 42.1 mt-10 69.2 7.13 6.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.292 1.219 . . . . 63.45 114.292 166.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -64.78 -51.35 62.69 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.969 0.414 . . . . 72.33 110.297 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -77.14 -23.61 51.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.262 -0.426 . . . . 75.34 110.477 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.704 HD12 ' HG2' ' B' ' 282' ' ' GLU . 68.5 mt -65.19 -53.19 43.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.936 -0.574 . . . . 70.35 110.862 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 11.3 pt-20 -67.49 -20.96 65.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.11 111.78 -178.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . 0.421 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 51.5 m-80 -106.54 5.59 29.3 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.778 0.288 . . . . 71.44 111.778 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.88 -47.42 80.5 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.116 -0.234 . . . . 62.02 111.187 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--N 1.326 -0.446 0 CA-C-N 116.149 -0.478 . . . . 71.1 111.013 -178.707 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.0 p-10 . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 109.018 -0.734 . . . . 74.34 109.018 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -78.79 -80.27 0.12 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.173 -0.467 . . . . 62.43 112.011 -171.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -98.78 -21.31 16.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.356 0.598 . . . . 60.02 110.768 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.68 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -133.16 -179.75 5.69 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.792 -0.64 . . . . 61.02 111.46 -173.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -83.67 46.13 1.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.334 -0.848 . . . . 65.03 111.871 -176.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -55.42 -41.13 72.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.772 0.32 . . . . 65.01 111.55 -176.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.39 -13.41 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 54.35 111.878 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 41.4 mmt180 -93.32 -60.34 1.81 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.765 -0.198 . . . . 73.04 110.627 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.789 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.31 -22.44 12.02 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.805 0.669 . . . . 73.12 112.805 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.592 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.7 t -68.37 -22.41 64.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.678 0.275 . . . . 71.25 110.768 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HB2' HD11 ' B' ' 217' ' ' LEU . 41.3 mt-10 -81.04 -27.61 35.69 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.319 0.58 . . . . 74.43 109.631 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.789 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -70.36 -48.53 55.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.205 -0.907 . . . . 72.11 109.724 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.459 HG13 ' HB1' ' B' ' 239' ' ' ALA . 80.6 mt -66.53 -27.86 41.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.469 0.652 . . . . 64.33 109.91 175.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.592 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.1 OUTLIER -66.74 -29.07 68.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.448 -0.796 . . . . 64.14 110.743 -177.362 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.663 HD12 HD13 ' B' ' 214' ' ' LEU . 2.8 tm? -75.25 -36.67 61.25 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.329 -0.619 . . . . 71.45 109.329 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.16 -28.45 70.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.801 -0.636 . . . . 64.41 110.462 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -76.9 -19.27 57.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.941 -0.572 . . . . 72.22 110.263 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.588 HE21 ' HD2' ' A' ' 16' ' ' LYS . 76.0 mm-40 -73.02 -41.82 63.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.68 -0.691 . . . . 71.41 109.474 176.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -78.93 -19.88 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.31 -0.859 . . . . 70.03 110.034 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.41 -5.86 53.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.663 -0.699 . . . . 44.24 110.128 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -75.55 -9.77 58.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.24 -0.436 . . . . 74.2 110.607 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.48 HD22 HG13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -78.64 111.48 14.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 72.44 109.726 178.579 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 25' ' ' THR . 2.9 t -73.37 -27.28 61.39 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.809 -0.632 . . . . 61.45 112.018 -174.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.406 ' HG2' HD22 ' A' ' 24' ' ' ASN . 1.8 pm0 -87.26 -3.39 59.04 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.494 0.553 . . . . 64.22 112.494 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.48 HG13 HD22 ' A' ' 24' ' ' ASN . 7.1 mt -107.45 149.51 10.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.806 -0.442 . . . . 65.53 109.806 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.08 145.06 32.63 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.16 -0.681 . . . . 72.1 109.16 177.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.491 HG22 ' HZ ' ' B' ' 247' ' ' PHE . 6.6 m -60.35 -25.11 65.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.203 0.525 . . . . 63.33 110.382 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.66 -15.74 71.3 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.691 -0.686 . . . . 73.21 112.884 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -81.28 -31.94 33.45 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.367 -0.605 . . . . 74.24 109.367 176.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -72.36 -44.78 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.467 -0.788 . . . . 63.04 110.443 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.0 p -60.91 -39.37 89.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.181 0.515 . . . . 64.21 110.471 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.56 72.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 74.31 110.788 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.414 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 51.6 m -67.96 -37.27 81.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.769 0.318 . . . . 75.31 110.159 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.566 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.1 t80 -68.24 -36.18 79.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.105 -0.702 . . . . 61.23 109.105 175.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.591 ' SD ' HD21 ' B' ' 240' ' ' LEU . 10.3 tpt -60.18 -60.75 3.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.919 -1.037 . . . . 73.22 110.974 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.486 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 30.7 t-105 -59.52 -33.68 71.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.477 -0.783 . . . . 64.35 111.428 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.401 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.0 -41.52 90.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 61.42 111.586 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.59 HD13 ' HB3' ' B' ' 236' ' ' PHE . 50.3 tp -67.35 -33.1 74.53 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.983 0.42 . . . . 74.54 110.482 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -62.2 -40.12 95.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 22.12 110.839 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 42' ' ' ARG . 38.2 mtp85 -74.74 -34.8 62.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.804 -0.634 . . . . 72.12 110.823 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.518 ' HD2' HG23 ' B' ' 215' ' ' ILE . 9.9 t80 -76.53 -35.38 58.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 74.45 110.739 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -75.1 -34.95 61.78 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 111.807 0.299 . . . . 74.34 111.807 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.521 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -68.47 -14.87 63.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.974 0.416 . . . . 75.5 111.361 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -58.11 -32.72 68.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.764 -0.653 . . . . 72.44 110.323 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.574 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 78.1 m-85 -80.38 -7.74 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.902 -0.59 . . . . 34.31 111.917 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.431 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -58.89 -34.93 80.47 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.452 -0.88 . . . . 64.4 111.779 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.1 t -72.79 -19.55 61.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.734 0.302 . . . . 71.51 111.087 -178.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 p -89.72 -14.21 35.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.783 0.325 . . . . 73.4 110.877 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.1 m -70.91 -32.49 69.44 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.258 -0.428 . . . . 75.15 111.951 -174.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -179.15 7.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.116 0.484 . . . . 62.22 111.537 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -99.77 -47.98 4.87 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.083 -0.962 . . . . 75.41 111.097 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.2 p -99.7 159.1 15.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.691 -0.231 . . . . 75.53 110.596 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -68.1 -34.95 77.35 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.083 0.24 . . . . 72.13 111.14 -175.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.31 -47.49 82.02 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.972 0.415 . . . . 73.32 110.53 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.594 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -75.43 -32.73 60.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 54.34 110.314 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.1 ttt -66.26 -45.7 79.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.021 -0.536 . . . . 73.55 110.782 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.49 ' HB2' HG21 ' B' ' 285' ' ' ILE . 34.0 tt0 -67.15 -29.82 69.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.815 -0.63 . . . . 73.12 110.753 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.84 -4.11 26.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.379 -0.373 . . . . 60.12 111.692 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.594 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.3 mmmm -117.67 4.66 12.32 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 120.75 0.31 . . . . 64.5 110.491 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 16.3 ptmt -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.9 -0.591 . . . . 72.33 110.736 -174.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.411 HE22 ' HE2' ' B' ' 274' ' ' LYS . 16.4 tp60 -68.75 -26.08 65.06 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.87 0.367 . . . . 75.12 110.559 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.76 -42.97 69.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.974 -0.557 . . . . 65.51 111.644 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.546 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.8 ptt? -83.75 -27.08 29.15 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.17 -0.612 . . . . 63.3 109.782 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.641 ' HG2' HD22 ' B' ' 277' ' ' LEU . 75.7 mtp -78.47 -17.79 55.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.628 -0.715 . . . . 75.42 111.575 -178.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.44 -24.75 66.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.525 -0.917 . . . . 73.3 108.525 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.536 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 34.7 m-85 -93.71 -32.96 13.82 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 114.414 -1.266 . . . . 74.01 111.199 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.434 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 23.1 m-85 -60.98 -45.13 96.01 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.204 -0.665 . . . . 71.05 109.204 175.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.48 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -67.04 -59.83 3.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.375 -0.375 . . . . 72.31 110.039 169.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -106.34 81.54 1.62 Allowed 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 113.189 0.811 . . . . 74.33 113.189 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.536 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 7.9 mmm180 -147.13 -31.16 0.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.731 -0.668 . . . . 72.23 109.757 164.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.629 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -93.08 10.87 29.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.309 -0.626 . . . . 71.32 109.309 178.148 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -66.36 -56.32 11.67 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.271 -0.877 . . . . 55.23 110.076 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.62 -36.81 77.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.477 -0.329 . . . . 64.41 110.925 177.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.0 mtt -62.67 -41.08 98.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.238 0.542 . . . . 74.01 110.05 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.547 HD22 ' HG2' ' B' ' 266' ' ' MET . 1.2 tt -71.89 -42.11 67.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.486 -0.779 . . . . 43.31 110.144 -176.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.74 -39.85 82.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.26 0.553 . . . . 54.21 109.948 175.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.45 -21.22 66.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.324 -0.853 . . . . 72.13 111.365 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -93.36 -24.04 18.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 70.44 110.25 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.406 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 25.4 mmt -63.2 -45.59 91.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.523 -0.917 . . . . 71.33 108.523 169.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 43.4 mm-40 -68.21 12.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.24 -0.891 . . . . 75.23 111.916 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -93.01 -55.5 3.32 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.902 -0.777 . . . . 54.42 108.902 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.785 -0.643 . . . . 71.34 111.808 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.7 mt -62.3 -57.39 12.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.491 0.186 . . . . 73.03 111.433 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.7 pt-20 -69.18 -15.74 63.47 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.125 0.417 . . . . 42.21 112.125 -175.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -109.13 10.3 25.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.998 -0.281 . . . . 75.12 110.942 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.516 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 71.5 t80 -57.87 -47.93 81.3 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.451 -0.34 . . . . 72.3 111.106 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.5 t70 . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 116.384 -0.371 . . . . 65.03 110.443 -177.011 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.757 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 0.5 OUTLIER . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.822 -0.436 . . . . 73.42 109.822 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -91.05 -75.85 0.46 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.095 -0.706 . . . . 52.32 109.095 178.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -115.5 -37.38 4.02 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.52 -0.919 . . . . 73.15 108.52 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.757 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -93.99 150.97 19.88 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.162 -0.926 . . . . 73.05 111.764 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.468 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -71.68 57.89 0.3 Allowed 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 125.064 1.346 . . . . 63.32 113.146 -179.639 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -51.67 -43.06 62.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.479 0.548 . . . . 71.22 112.479 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.25 -27.76 69.23 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.946 0.721 . . . . 74.35 112.946 -174.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' B' ' 210' ' ' ARG . 19.5 mmt180 -87.66 -56.49 3.33 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.939 -0.304 . . . . 62.41 111.642 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.601 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -51.75 -25.73 8.1 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.689 0.626 . . . . 73.13 112.689 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 6.2 t -69.32 -23.63 63.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 121.336 -0.146 . . . . 52.34 111.357 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -81.71 -27.87 33.7 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.1 -0.704 . . . . 72.31 109.1 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.663 HD13 HD12 ' A' ' 17' ' ' LEU . 3.4 mm? -67.08 -51.78 50.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.78 -1.1 . . . . 73.31 109.467 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.518 HG23 ' HD2' ' A' ' 43' ' ' TYR . 78.1 mt -63.67 -30.37 49.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.515 -0.766 . . . . 75.54 110.227 176.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.497 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.0 OUTLIER -59.62 -36.98 77.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.8 -0.636 . . . . 70.23 110.82 -177.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.603 ' HA ' ' NE2' ' B' ' 220' ' ' GLN . 3.0 tm? -67.61 -40.01 84.74 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.128 -0.693 . . . . 71.4 109.128 178.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.16 66.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.716 -0.675 . . . . 72.35 110.707 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.562 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -66.28 -42.06 88.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.781 -0.645 . . . . 74.15 110.488 176.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . 0.603 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -61.78 -43.85 98.04 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.834 0.349 . . . . 74.43 111.158 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -70.16 -21.6 63.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.201 0.524 . . . . 73.21 110.379 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.51 -13.38 59.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.687 -0.688 . . . . 74.54 109.891 177.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.562 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 20.3 mm-40 -83.77 -2.07 55.55 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.318 -0.401 . . . . 74.51 110.218 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.561 HD22 HG13 ' B' ' 227' ' ' ILE . 1.4 t30 -81.46 103.26 11.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.114 -0.698 . . . . 71.23 109.114 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.1 t -59.25 -28.77 67.01 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 113.412 0.893 . . . . 74.04 113.412 -171.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -87.22 -0.29 56.48 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.931 0.345 . . . . 74.33 111.931 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.561 HG13 HD22 ' B' ' 224' ' ' ASN . 5.7 mt -112.24 149.49 14.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.866 -0.42 . . . . 64.55 109.866 177.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.471 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 0.3 OUTLIER -88.81 151.41 22.4 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.308 -0.627 . . . . 74.04 109.308 178.723 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.8 m -57.51 -30.83 65.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.262 0.554 . . . . 64.21 110.202 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . 0.574 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.8 -16.14 74.22 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.461 -0.79 . . . . 71.45 113.645 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.471 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 7.7 mm-40 -87.79 -24.98 23.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.552 0.676 . . . . 64.54 109.642 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.13 -40.4 44.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 73.03 110.242 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.7 p -63.15 -39.04 93.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.202 0.525 . . . . 72.14 110.271 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.9 -32.99 74.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.751 -0.659 . . . . 64.33 110.837 178.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 46.8 m -66.73 -37.37 84.53 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.105 0.478 . . . . 61.02 110.101 178.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.59 ' HB3' HD13 ' A' ' 40' ' ' LEU . 4.4 t80 -67.76 -35.67 79.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 73.34 109.696 177.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.629 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.3 ttm -67.06 -50.26 62.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.685 -0.689 . . . . 51.11 111.489 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -59.49 -38.79 81.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.073 0.463 . . . . 63.44 110.728 178.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.459 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.09 -41.07 91.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.01 -0.541 . . . . 74.44 111.443 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.591 HD21 ' SD ' ' A' ' 37' ' ' MET . 53.1 tp -65.67 -33.71 76.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.893 0.378 . . . . 55.21 110.557 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.2 -40.53 97.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 55.25 110.773 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.8 mtp85 -70.7 -42.15 71.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.061 -0.518 . . . . 72.31 110.604 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -70.6 -37.96 73.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.79 -0.641 . . . . 72.41 111.179 -174.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -71.83 -34.79 69.6 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.964 0.357 . . . . 52.3 111.964 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -65.74 -25.69 67.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 64.5 111.153 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -59.56 -33.84 71.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.637 -0.71 . . . . 74.33 110.113 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.491 ' HZ ' HG22 ' A' ' 29' ' ' THR . 71.5 m-85 -83.68 -8.71 59.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.31 -0.405 . . . . 73.21 111.33 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . 0.515 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -73.56 -30.94 61.38 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.23 -0.986 . . . . 64.24 110.661 171.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 34.9 t -70.12 -12.25 61.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.299 -0.451 . . . . 62.24 111.141 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.1 t -113.61 14.07 18.82 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.041 0.448 . . . . 72.11 110.27 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 29.0 t -88.95 -35.65 16.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.163 -0.472 . . . . 71.01 110.641 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.507 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.5 OUTLIER -137.95 174.01 11.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.761 0.315 . . . . 75.02 111.579 178.895 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -92.87 -30.61 15.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.773 -0.649 . . . . 72.43 112.325 -170.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.2 p -120.58 156.12 32.27 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.811 -0.177 . . . . 65.43 110.63 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.516 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 12.6 ptmm? -64.33 -29.11 70.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 72.53 110.37 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . 0.49 ' OE2' ' HG3' ' B' ' 255' ' ' LYS . 19.9 mm-40 -63.4 -57.58 9.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 75.43 110.651 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.697 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 22.2 mt-30 -68.94 -39.09 79.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.968 -0.56 . . . . 74.41 110.651 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.41 -44.08 96.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.285 -0.416 . . . . 75.1 110.883 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 7.8 tt0 -62.79 -35.78 80.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.089 0.471 . . . . 74.55 110.835 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -74.07 -5.81 43.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.006 -0.543 . . . . 64.23 111.094 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.697 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 14.3 mmmm -114.3 6.79 16.24 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.509 -0.314 . . . . 74.24 110.448 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.569 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 17.8 ptpt -56.95 -53.2 60.75 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 120.678 -0.409 . . . . 70.43 110.226 -177.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.556 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 15.0 tp60 -72.45 -22.01 61.15 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.847 -0.427 . . . . 72.14 109.847 -177.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -69.91 -42.44 73.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.6 -0.727 . . . . 65.4 111.299 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.569 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.6 ptt? -88.13 -27.7 21.74 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.211 0.529 . . . . 73.1 109.97 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.547 ' HG2' HD22 ' A' ' 77' ' ' LEU . 80.6 mtp -74.58 -17.51 60.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.684 -0.689 . . . . 75.34 110.611 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -62.37 -30.12 70.96 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.92 -0.77 . . . . 73.35 108.92 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.567 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.7 m-85 -86.7 -35.38 19.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.483 -1.235 . . . . 55.45 111.157 178.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.53 ' HA ' ' HE1' ' A' ' 37' ' ' MET . 22.6 m-30 -61.09 -44.29 97.59 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.485 -0.561 . . . . 73.23 109.485 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.431 ' HE3' ' N ' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.55 -57.3 5.38 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.352 -0.539 . . . . 73.01 109.679 171.256 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 7.0 t70 -108.53 81.42 1.47 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.657 0.614 . . . . 74.23 112.657 -172.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.567 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 5.8 mmm180 -156.81 -26.81 0.09 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.945 -0.57 . . . . 73.15 110.029 166.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.405 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -95.27 9.32 40.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.469 -0.937 . . . . 74.54 108.469 174.191 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.437 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 62.1 tttm -64.29 -59.32 4.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.248 -1.342 . . . . 61.21 110.356 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -55.3 -38.86 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 54.53 111.013 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . 0.486 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 50.2 mtt -60.63 -40.99 93.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.447 0.641 . . . . 73.43 110.412 177.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.641 HD22 ' HG2' ' A' ' 66' ' ' MET . 0.9 OUTLIER -75.01 -41.34 59.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.283 -0.871 . . . . 74.43 110.274 -178.006 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -57.87 -44.53 86.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 74.01 110.242 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.47 69.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.127 -0.942 . . . . 44.23 111.748 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -83.57 -21.49 32.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.9 0.381 . . . . 74.4 110.528 -178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.521 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 24.3 mmt -68.26 -52.97 27.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.038 -0.528 . . . . 72.43 110.14 175.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.688 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 40.1 mm-40 -51.08 -37.56 46.43 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.319 -0.855 . . . . 73.1 112.338 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -50.0 -42.75 49.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.697 0.284 . . . . 62.13 111.676 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -86.86 -32.16 20.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.857 0.36 . . . . 74.01 110.595 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.49 HG21 ' HB2' ' A' ' 59' ' ' GLN . 70.5 mt -66.28 -55.31 19.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.935 -0.575 . . . . 74.14 111.521 -177.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.688 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -75.08 -6.58 50.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 72.43 111.758 -175.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -116.37 12.37 15.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.328 -0.396 . . . . 75.53 110.857 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -53.0 -49.23 66.61 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.192 0.307 . . . . 71.33 111.037 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.862 -0.608 . . . . 72.11 111.134 179.341 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.5 p-10 . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 109.612 -0.514 . . . . 75.34 109.612 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -81.77 -81.66 0.14 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.762 0.315 . . . . 71.3 110.967 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -111.16 -33.13 6.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.899 0.381 . . . . 72.24 110.875 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.46 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -104.76 159.64 15.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.081 0.467 . . . . 72.52 111.363 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.1 OUTLIER -76.78 53.66 0.93 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.164 -0.925 . . . . 74.54 112.481 -177.531 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.425 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 37.8 m-85 -54.39 -38.99 66.81 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.862 0.363 . . . . 71.11 111.253 -178.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.44 -14.36 60.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.814 -0.63 . . . . 74.31 112.207 -176.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.616 ' NH1' ' HB3' ' B' ' 231' ' ' GLU . 64.5 mtt180 -93.5 -59.98 1.88 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.051 -0.352 . . . . 74.43 110.051 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.511 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.83 -25.94 21.92 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.766 -0.652 . . . . 60.41 112.657 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.5 t -63.95 -22.9 67.13 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.634 0.254 . . . . 61.23 111.296 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.546 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.9 mt-10 -90.98 -32.25 16.02 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.913 0.387 . . . . 74.35 109.969 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.614 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.6 mm? -61.92 -45.96 91.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.157 -0.683 . . . . 63.24 109.157 176.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.598 HG23 ' HD2' ' B' ' 243' ' ' TYR . 92.3 mt -66.86 -28.42 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.404 -0.817 . . . . 64.31 110.399 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.2 OUTLIER -68.49 -29.91 68.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.857 -0.61 . . . . 70.44 110.575 -177.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.489 HD12 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -69.86 -44.63 69.45 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.69 -0.856 . . . . 75.23 108.69 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.85 -33.1 74.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.374 -0.83 . . . . 64.44 109.965 178.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 5.4 t-20 -57.23 -38.7 74.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.221 -0.9 . . . . 52.15 110.396 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -67.01 -42.17 85.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 63.21 111.368 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -74.26 -20.32 60.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.053 0.454 . . . . 74.14 110.53 -177.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -88.04 0.21 56.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 55.24 110.68 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.9 mm-40 -80.77 55.23 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.868 0.366 . . . . 62.42 110.467 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.511 ' ND2' HG13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -144.62 142.48 30.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 51.53 109.873 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.5 t -93.18 -43.36 8.89 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.291 0.478 . . . . 53.12 112.291 -176.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -73.7 -24.75 59.98 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.382 0.512 . . . . 75.45 112.382 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.511 HG13 ' ND2' ' A' ' 24' ' ' ASN . 5.6 mt -83.76 143.98 10.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.296 -0.631 . . . . 71.43 109.296 177.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.655 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -83.42 150.68 25.9 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.997 -0.547 . . . . 53.53 110.017 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 m -56.37 -33.28 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.657 -0.702 . . . . 73.02 111.375 -175.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.586 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -63.14 -26.53 69.33 Favored Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.945 -0.57 . . . . 42.44 113.997 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.655 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 51.8 mm-40 -62.97 -28.43 70.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 117.318 0.559 . . . . 72.4 111.172 -176.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.67 -46.78 15.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 73.51 110.825 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 m -55.7 -40.11 71.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 63.13 110.983 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.78 68.37 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.14 -0.482 . . . . 64.3 111.229 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.5 m -66.9 -32.08 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 74.42 110.107 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.614 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.5 t80 -68.45 -33.11 73.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.872 -0.604 . . . . 74.41 109.854 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.568 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.5 ttm -68.09 -49.72 59.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 74.51 111.407 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.477 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 29.3 t-105 -62.02 -37.59 85.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.076 0.465 . . . . 73.25 110.669 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.42 -34.32 76.98 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 54.34 111.264 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.4 tp -65.64 -35.71 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 120.942 0.401 . . . . 74.23 110.029 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.524 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -62.11 -54.18 44.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.876 -0.602 . . . . 73.04 110.985 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -61.9 -32.82 73.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.644 -0.253 . . . . 74.1 111.602 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.403 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 11.1 t80 -77.4 -39.33 47.49 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.972 -0.291 . . . . 72.41 110.917 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -70.31 -35.41 73.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 75.15 110.806 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -69.54 -11.53 60.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.488 . . . . 73.24 111.129 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.403 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 19.2 t90 -74.19 -15.28 61.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.444 0.64 . . . . 73.1 109.833 176.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -97.8 -0.93 44.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.998 0.428 . . . . 75.2 111.142 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -74.94 -29.84 60.26 Favored Glycine 0 N--CA 1.443 -0.841 0 C-N-CA 120.47 -0.872 . . . . 74.44 111.009 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 1.024 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 7.0 p -73.15 -5.37 38.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.754 0.311 . . . . 73.3 111.826 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -120.19 14.01 12.11 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.428 . . . . 63.02 110.372 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -76.66 -54.93 5.99 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.163 -0.471 . . . . 54.04 111.884 -178.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.687 ' HE2' ' HE2' ' A' ' 61' ' ' LYS . 3.0 m-85 -128.87 173.55 10.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.034 0.445 . . . . 74.11 112.076 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.517 ' HG3' HG23 ' A' ' 54' ' ' THR . 12.1 pt-20 -88.51 -36.08 16.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.28 -0.873 . . . . 73.45 111.459 -172.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.517 HG23 ' HG3' ' A' ' 53' ' ' GLU . 62.9 p -119.85 151.53 38.72 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 116.105 -0.498 . . . . 74.54 110.283 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.577 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 21.2 ptmt -68.6 -25.07 64.68 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.652 -0.499 . . . . 54.23 109.652 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -55.2 -40.39 70.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.579 -0.737 . . . . 71.53 110.468 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.681 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 15.2 mt-30 -93.84 -43.32 8.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.623 -0.717 . . . . 64.03 110.311 178.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 1.024 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.5 ttt -58.11 -40.64 81.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.642 -0.708 . . . . 71.12 111.904 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.738 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.8 tt0 -64.38 -41.92 96.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.814 0.34 . . . . 54.13 110.633 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.56 -18.29 64.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.097 -0.502 . . . . 64.44 111.164 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.687 ' HE2' ' HE2' ' A' ' 52' ' ' PHE . 32.3 mmmt -91.28 0.35 57.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.11 -0.495 . . . . 70.02 110.54 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HG2' ' N ' ' A' ' 63' ' ' GLN . 1.5 ptmm? -55.15 -43.05 73.88 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.829 -0.434 . . . . 64.23 109.829 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.41 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 11.1 tp60 -82.76 -19.61 37.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.278 -0.419 . . . . 64.45 110.521 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.17 -30.5 20.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.028 -0.533 . . . . 73.1 111.584 -175.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.3 ptp -82.02 -27.52 33.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.189 -1.041 . . . . 73.24 108.189 177.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.8 mtp -85.97 -10.02 55.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.899 -1.046 . . . . 73.12 110.429 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -53.05 -43.55 66.72 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.724 -0.671 . . . . 72.5 111.791 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.57 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 6.6 p90 -109.69 -1.53 17.98 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.159 -0.473 . . . . 73.35 111.215 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.677 ' HD2' HD21 ' B' ' 277' ' ' LEU . 4.2 m-30 -63.0 -46.99 85.04 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.52 0.2 . . . . 73.53 110.759 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.478 ' HE1' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.1 -46.22 72.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.415 0.626 . . . . 65.03 110.042 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -89.65 14.07 12.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.089 -0.959 . . . . 75.41 112.172 -168.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.736 ' NE ' ' HA ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -86.08 -43.05 13.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.584 -0.697 . . . . 73.32 111.443 -172.065 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.685 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -98.68 15.29 25.68 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.389 -0.524 . . . . 55.54 110.212 -178.347 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.589 ' HE3' ' HG2' ' B' ' 270' ' ' MET . 32.8 ttmt -62.86 -52.92 61.26 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.705 -0.68 . . . . 72.13 109.576 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 75' ' ' GLU . 6.4 pt-20 -57.49 -41.41 80.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.137 -0.938 . . . . 73.4 111.135 177.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -61.16 -47.32 86.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.262 0.554 . . . . 73.2 110.592 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.591 HD13 ' HE1' ' B' ' 270' ' ' MET . 1.0 OUTLIER -69.66 -36.09 75.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.245 -0.889 . . . . 72.43 110.63 -174.551 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.46 ' N ' ' HE1' ' B' ' 266' ' ' MET . 19.2 t70 -61.12 -31.2 70.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.237 0.542 . . . . 51.22 110.532 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.9 59.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.602 -0.726 . . . . 72.34 111.524 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -105.46 -16.57 14.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.057 0.456 . . . . 75.41 110.662 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.446 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 20.9 mmt -75.97 -179.15 4.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.797 -0.638 . . . . 73.24 111.415 177.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.603 ' HA ' ' CG1' ' A' ' 85' ' ' ILE . 40.5 mt-10 67.8 8.74 6.63 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.878 -1.055 . . . . 64.01 113.718 171.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.29 -55.26 35.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.145 0.497 . . . . 74.13 110.648 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -85.24 -10.23 56.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.95 -0.568 . . . . 70.44 111.012 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.603 ' CG1' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -76.0 -57.33 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 120.757 0.313 . . . . 74.43 110.744 -178.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.0 pt-20 -66.8 -25.56 66.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.735 0.302 . . . . 74.12 110.872 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -99.0 7.26 46.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.337 -0.392 . . . . 65.15 111.304 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.404 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 77.8 t80 -60.02 -39.34 85.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.708 0.289 . . . . 73.24 110.466 -179.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 . . . . . 0 C--N 1.327 -0.404 0 CA-C-O 121.324 0.583 . . . . 70.14 110.478 176.597 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.692 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.368 0 N-CA-C 108.805 -0.813 . . . . 74.11 108.805 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.14 -79.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.799 0.333 . . . . 75.04 111.502 -176.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.41 -56.32 2.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.1 0.476 . . . . 63.13 110.112 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -71.28 160.39 32.89 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.757 -0.656 . . . . 61.55 110.642 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.477 ' HE1' ' CB ' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -76.62 52.26 0.8 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.598 -0.728 . . . . 73.23 112.251 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.692 ' HD2' ' HB2' ' B' ' 203' ' ' ASN . 55.8 m-85 -55.62 -37.51 68.27 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.965 0.412 . . . . 73.35 111.179 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -70.49 -20.6 62.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.537 . . . . 74.1 111.689 -176.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.41 ' NH1' ' HB3' ' A' ' 31' ' ' GLU . 79.4 mtt180 -91.6 -60.6 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.83 0.348 . . . . 73.13 110.228 -177.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.78 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -56.7 -22.88 38.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.715 -0.675 . . . . 72.12 112.669 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -65.97 -24.82 66.87 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.591 0.234 . . . . 71.32 110.741 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 38.8 mt-10 -83.04 -25.94 31.64 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.423 0.63 . . . . 62.14 109.865 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.59 -42.84 91.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.351 -0.84 . . . . 70.23 109.512 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 79.6 mt -68.58 -26.53 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.629 -0.714 . . . . 62.22 110.221 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.513 ' HB2' ' O ' ' B' ' 213' ' ' GLU . 10.6 mmmm -60.73 -42.27 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.056 -0.52 . . . . 75.24 111.66 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.576 HD12 HD13 ' A' ' 14' ' ' LEU . 2.6 tm? -64.33 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.164 -0.68 . . . . 63.02 109.164 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -72.28 -37.55 68.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.777 -0.647 . . . . 74.33 109.979 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.644 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.2 m-20 -61.0 -34.28 74.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 72.53 110.689 176.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.07 -38.37 79.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 72.34 111.572 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -76.61 -22.61 53.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.348 0.594 . . . . 73.22 110.198 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -78.99 -13.28 59.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.261 -0.882 . . . . 70.5 110.714 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 84.8 mm-40 -72.3 -7.36 49.06 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.336 0.495 . . . . 74.11 112.336 -176.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.737 HD22 HG13 ' B' ' 227' ' ' ILE . 9.5 t30 -71.43 166.8 20.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 72.54 110.194 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.6 t -116.48 3.01 13.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.772 0.32 . . . . 63.32 111.43 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -128.93 7.08 5.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.023 0.379 . . . . 74.1 112.023 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.737 HG13 HD22 ' B' ' 224' ' ' ASN . 4.5 mt -109.9 144.45 18.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.284 -0.566 . . . . 75.22 110.118 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -79.4 142.26 36.13 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.162 -0.927 . . . . 71.05 109.066 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 39.3 m -60.2 -27.64 67.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.063 0.459 . . . . 75.41 110.649 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.85 -15.42 76.01 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.912 -0.585 . . . . 74.42 112.843 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.616 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 68.1 mm-40 -78.25 -18.22 55.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 117.194 0.497 . . . . 74.12 110.467 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.3 -38.25 10.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.669 -0.696 . . . . 75.04 110.497 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.1 p -64.4 -38.77 92.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.236 0.541 . . . . 71.4 110.347 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.12 -37.47 85.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.776 -0.647 . . . . 55.21 111.103 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.49 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 2.3 p -71.65 -26.41 62.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.97 -0.292 . . . . 54.55 110.748 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.549 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 6.9 t80 -70.28 -40.63 74.21 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.088 -0.708 . . . . 72.53 109.088 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.685 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.7 ttm -65.79 -47.87 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.48 -0.782 . . . . 74.44 111.344 178.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -60.92 -38.42 85.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.995 0.426 . . . . 74.35 110.701 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.465 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.2 -33.15 75.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 63.42 111.449 -178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.584 HD13 ' HB3' ' A' ' 36' ' ' PHE . 49.3 tp -70.05 -34.95 73.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.976 0.417 . . . . 70.42 109.891 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.48 -48.86 77.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.788 -0.642 . . . . 75.33 110.821 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -77.95 -14.9 59.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 63.31 111.028 -175.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.598 ' HD2' HG23 ' A' ' 15' ' ' ILE . 28.0 t80 -89.13 -48.91 7.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.222 0.534 . . . . 70.45 110.349 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -78.58 -16.38 57.48 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.846 -0.615 . . . . 73.15 112.015 -170.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -66.99 -15.42 63.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.147 0.499 . . . . 61.32 111.008 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -56.96 -31.74 65.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.443 -0.799 . . . . 64.32 111.506 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.586 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 67.9 m-85 -73.5 -11.64 60.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.316 -0.402 . . . . 73.21 112.0 -175.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.42 95.76 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.15 -1.024 . . . . 65.52 111.384 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . 0.917 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 13.1 m -66.85 -13.17 61.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.057 0.392 . . . . 51.2 112.057 -175.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.8 t -116.81 18.29 14.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.072 0.463 . . . . 53.54 110.582 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 30.2 t -83.48 -49.24 9.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 75.24 111.568 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 1.6 m-85 -139.5 -179.45 5.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.653 0.612 . . . . 74.25 112.653 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.599 ' HG3' HG23 ' B' ' 254' ' ' THR . 15.5 pt-20 -92.13 -36.41 13.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.836 -1.074 . . . . 75.12 112.043 -171.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.599 HG23 ' HG3' ' B' ' 253' ' ' GLU . 69.8 p -123.17 154.92 38.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.328 -0.396 . . . . 72.11 110.181 -176.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.404 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 22.7 ptmt -65.04 -29.78 70.71 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.154 0.284 . . . . 71.43 110.72 -178.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -59.0 -53.03 63.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.281 0.562 . . . . 75.35 110.849 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.637 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.8 mt-30 -78.54 -35.3 46.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.663 -0.699 . . . . 71.43 110.361 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.917 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 25.6 ttt -64.26 -42.86 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.895 -0.593 . . . . 72.15 111.105 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.45 -35.48 79.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 75.24 110.887 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.6 2.9 7.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.925 0.393 . . . . 70.54 111.459 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.637 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.7 mmmt -114.65 -0.16 13.71 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 109.895 -0.409 . . . . 73.14 109.895 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.458 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 9.9 ptmt -55.22 -52.17 64.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.84 -0.618 . . . . 61.15 110.942 -173.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.458 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.5 tp60 -76.72 -26.05 54.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 109.985 -0.376 . . . . 71.24 109.985 -177.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -75.05 -34.13 61.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.05 -0.523 . . . . 75.34 111.633 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 22.0 ptp -81.49 -29.26 33.73 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.372 -0.973 . . . . 75.41 108.372 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.478 ' HG2' HD22 ' A' ' 77' ' ' LEU . 68.0 mtp -80.86 -19.17 45.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.914 -1.039 . . . . 71.41 111.253 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -68.64 -27.32 65.9 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-O 122.079 0.942 . . . . 73.55 108.5 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -99.94 8.8 43.81 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.216 -1.356 . . . . 71.22 111.277 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.4 m-30 -97.05 -45.93 6.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 106.951 -1.5 . . . . 74.31 106.951 165.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.591 ' HE1' HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -59.69 -66.05 0.58 Allowed 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.407 -0.815 . . . . 73.52 110.53 170.486 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . 0.575 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 4.8 t70 -102.03 76.5 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.101 0.408 . . . . 73.21 112.101 -171.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.575 ' HG2' ' O ' ' B' ' 271' ' ' ASP . 1.8 mmp_? -152.23 -28.92 0.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 72.12 111.383 170.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.568 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.62 1.44 42.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.525 -0.917 . . . . 74.23 108.525 174.613 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.48 -49.32 77.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.485 -1.234 . . . . 64.12 110.692 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.75 -42.65 99.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 73.12 110.866 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 54.3 mtt -61.55 -47.65 84.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.625 -0.716 . . . . 73.0 109.676 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.677 HD21 ' HD2' ' A' ' 69' ' ' TYR . 34.3 tp -59.9 -42.86 94.77 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.644 -1.162 . . . . 52.44 111.165 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.94 -43.13 99.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.196 0.522 . . . . 73.21 110.14 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.04 -20.75 60.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.391 -0.822 . . . . 53.04 111.525 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -87.95 -9.51 53.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 74.3 110.634 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.428 ' HG2' ' HB1' ' A' ' 45' ' ' ALA . 58.3 mtt -93.35 -169.23 2.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.104 -0.498 . . . . 75.32 111.07 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.782 ' HG2' HD12 ' B' ' 285' ' ' ILE . 38.4 mt-10 69.47 13.93 8.36 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.899 -1.046 . . . . 75.32 112.311 177.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -65.48 -47.03 77.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.958 0.409 . . . . 71.5 110.073 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . 0.459 ' O ' ' HB2' ' B' ' 288' ' ' PHE . 4.3 m-85 -89.45 -5.44 57.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.508 -0.315 . . . . 72.43 111.006 174.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.782 HD12 ' HG2' ' B' ' 282' ' ' GLU . 60.8 mt -79.54 -59.79 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 110.138 -0.319 . . . . 60.4 110.138 178.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 3.1 pt-20 -65.56 -27.89 68.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.867 0.365 . . . . 45.11 110.701 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -98.52 7.09 46.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.426 -0.352 . . . . 75.04 111.054 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' B' ' 284' ' ' TYR . 76.9 t80 -64.35 -37.54 87.87 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.93 -0.767 . . . . 71.13 108.93 174.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 115.414 -0.812 . . . . 72.33 110.252 173.109 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.63 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.9 p-10 . . . . . 0 N--CA 1.452 -0.361 0 CA-C-O 121.096 0.474 . . . . 71.03 110.769 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.79 -72.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.583 -0.735 . . . . 72.4 111.111 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -120.63 -57.59 1.89 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.196 -0.456 . . . . 74.22 109.822 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.29 161.94 28.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.871 -0.604 . . . . 75.14 110.981 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.53 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -79.72 54.85 1.9 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.384 -0.826 . . . . 62.34 111.948 -179.078 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 33.0 m-85 -52.14 -45.29 64.94 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.379 -0.373 . . . . 73.14 111.962 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.54 -10.57 58.67 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 112.441 0.534 . . . . 64.24 112.441 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.463 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 95.5 mtt180 -91.33 -62.07 1.52 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.901 -0.407 . . . . 54.31 109.901 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.773 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.28 -25.03 31.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.772 0.656 . . . . 71.32 112.772 -178.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 15.1 t -64.73 -20.81 66.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.147 -0.221 . . . . 75.03 111.321 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HB2' HD11 ' B' ' 217' ' ' LEU . 39.7 mt-10 -86.22 -30.81 22.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.423 -0.584 . . . . 73.5 109.423 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.68 -47.08 82.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.168 -0.924 . . . . 75.33 109.021 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.46 HG13 ' HB1' ' B' ' 239' ' ' ALA . 72.3 mt -67.16 -29.87 47.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.483 -0.781 . . . . 73.4 110.389 175.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 12' ' ' THR . 1.2 tmmt? -64.02 -32.31 73.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 62.15 110.475 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 17' ' ' LEU . 1.6 tm? -69.33 -43.88 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.997 -0.742 . . . . 75.53 108.997 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.8 84.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.947 -0.569 . . . . 71.54 110.694 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.529 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 8.0 m-80 -59.4 -32.89 70.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.842 -0.617 . . . . 73.41 110.944 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -73.88 -31.82 63.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 60.11 111.53 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -84.73 -22.33 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.827 0.346 . . . . 72.21 111.023 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -83.6 -0.48 50.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.275 0.56 . . . . 62.45 110.088 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.2 mm-40 -75.69 -13.69 60.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 73.23 109.814 173.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.647 HD22 HG13 ' A' ' 27' ' ' ILE . 2.0 t30 -69.2 114.98 7.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.513 -0.767 . . . . 72.01 109.681 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -62.65 -34.54 77.29 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.405 0.891 . . . . 70.03 113.405 -170.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 pm0 -90.96 1.19 57.24 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.42 -0.512 . . . . 73.43 112.175 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.647 HG13 HD22 ' A' ' 24' ' ' ASN . 7.6 mt -104.09 149.46 7.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.423 0.63 . . . . 75.14 110.158 177.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.545 ' CG ' ' HG3' ' A' ' 31' ' ' GLU . 16.8 pt20 -90.46 155.74 18.7 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.104 -0.953 . . . . 74.32 109.143 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 m -60.73 -21.51 63.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.478 0.656 . . . . 65.44 110.259 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.45 ' HA2' ' CZ ' ' B' ' 247' ' ' PHE . . . -67.15 -39.85 92.63 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.38 -0.827 . . . . 73.33 113.283 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.545 ' HG3' ' CG ' ' A' ' 28' ' ' GLN . 42.8 mt-10 -67.85 -32.03 72.27 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 117.488 0.644 . . . . 75.24 110.317 -174.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -72.68 -41.37 62.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.565 -0.743 . . . . 74.33 110.385 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -61.83 -44.73 96.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.211 0.529 . . . . 72.41 110.277 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.24 -32.55 73.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.867 -0.606 . . . . 62.02 111.031 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 48.8 m -66.0 -37.95 87.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 121.046 0.45 . . . . 61.33 109.905 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.649 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.6 t80 -63.77 -40.01 95.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.731 -0.668 . . . . 53.53 109.774 177.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.76 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.9 ttm -66.47 -46.19 77.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.609 -0.723 . . . . 65.54 111.831 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.453 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 19.9 t-105 -63.08 -36.94 85.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 74.13 110.947 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.497 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -66.44 -37.89 86.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.094 -0.503 . . . . 74.52 111.493 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.588 HD13 ' HB3' ' B' ' 236' ' ' PHE . 44.4 tp -69.98 -28.45 65.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.013 0.435 . . . . 72.4 110.375 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.561 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -63.16 -42.26 99.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.948 -0.569 . . . . 73.34 111.0 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -77.41 -28.91 52.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.923 0.392 . . . . 72.33 110.574 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -76.7 -35.13 58.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.124 -0.489 . . . . 74.43 110.574 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -77.92 -32.17 51.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.308 -0.405 . . . . 73.11 112.048 -178.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.89 -20.65 66.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.266 0.555 . . . . 51.44 110.708 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -60.13 -33.56 72.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.265 -0.879 . . . . 72.53 111.078 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.459 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.9 m-85 -77.92 -3.49 42.07 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.154 -0.475 . . . . 75.24 112.156 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.51 -27.48 70.94 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.163 -1.018 . . . . 72.21 110.748 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.774 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 3.7 m -65.32 -18.1 65.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.13 -0.535 . . . . 72.35 111.833 -177.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -114.69 20.33 15.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.056 0.455 . . . . 71.4 110.88 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -83.48 -59.51 2.42 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.375 -0.375 . . . . 72.02 111.586 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.698 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 4.8 m-85 -134.86 175.32 9.67 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.106 0.41 . . . . 64.22 112.106 -175.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.527 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.0 pt-20 -82.37 -40.29 21.53 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.707 -0.678 . . . . 75.45 111.854 -170.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.527 HG23 ' HG3' ' A' ' 53' ' ' GLU . 80.6 p -119.65 155.48 32.25 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.865 -0.42 . . . . 43.11 109.865 -178.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.5 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 12.1 ptmm? -67.44 -26.41 66.39 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.581 -0.448 . . . . 72.12 110.418 -176.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.0 -26.83 65.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.188 -0.46 . . . . 55.11 111.038 -177.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.734 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 17.8 mt-30 -97.21 -43.54 7.31 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.521 -0.548 . . . . 73.34 109.521 175.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.774 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 11.2 ttt -55.31 -44.21 75.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.169 -0.923 . . . . 55.03 111.721 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.427 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 47.5 tt0 -63.9 -42.42 97.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.077 -0.511 . . . . 65.51 110.827 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.71 -2.85 18.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.028 -0.533 . . . . 75.52 111.712 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.734 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 73.4 mmtt -104.1 1.05 30.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.422 -0.354 . . . . 52.14 110.826 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.528 ' O ' ' HG3' ' A' ' 66' ' ' MET . 0.0 OUTLIER -52.93 -46.01 67.92 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 123.209 0.318 . . . . 74.4 110.809 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.471 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 9.1 tp60 -77.91 -27.96 49.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.045 0.45 . . . . 74.02 110.014 -174.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -74.17 -29.38 61.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.892 -0.594 . . . . 72.32 111.176 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 ptp -86.1 -28.08 24.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.488 -0.56 . . . . 74.44 109.488 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.637 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 86.2 mtp -75.34 -18.14 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.548 -0.751 . . . . 73.14 111.313 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.0 -31.85 73.08 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.861 0.839 . . . . 51.41 109.465 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.44 ' HD2' ' CD ' ' A' ' 72' ' ' ARG . 85.9 m-85 -93.73 -4.34 50.6 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.639 -1.164 . . . . 73.35 111.155 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.637 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.8 m-30 -86.49 -53.87 4.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.014 -1.106 . . . . 74.42 108.014 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.53 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -58.96 -65.43 0.67 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.999 -0.546 . . . . 64.23 111.602 175.553 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.568 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 0.1 OUTLIER -98.77 24.2 7.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.861 1.43 . . . . 74.23 114.861 -159.807 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.44 ' CD ' ' HD2' ' A' ' 68' ' ' TYR . 1.2 mmp_? -112.96 -19.92 11.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.388 -0.925 . . . . 51.52 112.997 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.664 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -88.78 5.01 45.53 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.745 -0.835 . . . . 73.13 108.745 173.251 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -61.57 -57.75 10.83 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.414 -1.266 . . . . 74.03 110.519 -177.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.34 -33.68 76.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.183 -0.462 . . . . 70.21 111.708 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.496 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 44.6 mtm -74.35 -23.29 59.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.276 0.56 . . . . 50.45 110.16 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.557 HD22 ' HG2' ' B' ' 266' ' ' MET . 3.4 tt -76.68 -35.29 58.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.566 -0.743 . . . . 71.22 109.209 176.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.457 ' N ' ' HE1' ' B' ' 266' ' ' MET . 25.2 t70 -59.6 -37.21 77.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.054 -0.976 . . . . 55.11 111.213 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.37 -19.5 63.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.8 -0.636 . . . . 64.31 112.095 -178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.24 -3.51 31.32 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 74.32 111.852 -176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.489 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 24.1 mmt -85.51 -176.26 6.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.696 0.284 . . . . 74.43 110.534 175.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.756 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 63.0 -10.46 0.1 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 114.027 1.121 . . . . 74.02 114.027 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -56.17 -65.37 0.61 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.039 0.447 . . . . 63.52 111.381 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -72.91 -13.38 61.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.29 -0.414 . . . . 72.23 110.905 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.756 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.6 mt -76.89 -54.32 13.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.431 . . . . 72.43 110.83 -176.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.2 pt-20 -68.7 -22.37 64.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.982 0.42 . . . . 73.22 111.106 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -98.57 3.34 48.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.291 -0.413 . . . . 74.22 110.878 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 73.3 t80 -64.73 -37.42 87.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.733 -0.212 . . . . 75.41 110.491 -177.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.465 0.277 0 CA-C-O 121.584 0.707 . . . . 74.22 109.76 174.423 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.72 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 2.8 p-10 . . . . . 0 N--CA 1.449 -0.475 0 CA-C-O 121.023 0.439 . . . . 64.14 109.913 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -77.02 -76.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.995 -0.548 . . . . 55.42 110.891 -177.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -106.75 -45.31 4.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.472 0.653 . . . . 72.22 109.863 -178.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.72 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -102.18 169.33 8.79 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 73.14 111.173 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.53 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -83.77 54.25 2.82 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.833 0.853 . . . . 75.14 112.063 -177.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' B' ' 206' ' ' ALA . 29.1 m-85 -53.81 -43.54 69.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.474 . . . . 71.13 112.086 -175.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -71.34 -5.83 35.44 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.628 0.603 . . . . 43.24 112.628 -175.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -98.97 -59.97 1.62 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.906 -0.405 . . . . 73.24 109.906 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.909 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -59.35 -18.52 39.15 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.845 0.683 . . . . 63.12 112.845 -178.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.8 t -66.95 -19.62 65.75 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.131 -0.228 . . . . 61.44 111.094 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.407 ' HB2' HD11 ' A' ' 17' ' ' LEU . 33.4 mt-10 -86.67 -26.62 24.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.189 0.519 . . . . 73.23 109.894 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.909 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.45 -47.87 74.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.406 -0.815 . . . . 72.34 109.547 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.483 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.5 mt -66.3 -30.17 49.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.801 -0.636 . . . . 65.43 110.127 175.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' B' ' 216' ' ' LYS . 1.1 tmmt? -64.06 -31.85 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.575 -0.739 . . . . 71.12 111.204 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.668 HD12 HD13 ' A' ' 14' ' ' LEU . 2.8 tm? -67.86 -42.0 81.99 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.664 -0.865 . . . . 71.32 108.664 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.19 -35.8 76.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.677 -0.692 . . . . 60.13 110.719 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.434 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -63.2 -25.54 68.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.052 -0.522 . . . . 72.21 111.347 179.24 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.52 -36.26 29.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.45 -0.341 . . . . 71.11 111.304 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -74.77 -22.82 58.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.276 0.56 . . . . 61.44 110.354 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -72.65 -17.05 61.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.176 -0.92 . . . . 63.12 110.084 177.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 78.5 mm-40 -77.32 74.83 3.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.071 -0.513 . . . . 73.54 110.623 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.992 HD22 HG13 ' B' ' 227' ' ' ILE . 26.4 t30 -151.15 176.8 10.83 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.567 -0.901 . . . . 74.11 108.567 174.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.8 t -111.82 -37.94 4.99 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.397 -0.521 . . . . 74.33 112.082 -176.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -83.32 -28.02 29.35 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.171 0.434 . . . . 71.14 112.171 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.992 HG13 HD22 ' B' ' 224' ' ' ASN . 5.7 mt -76.87 151.01 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 72.52 110.257 -178.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.603 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 13.8 pm0 -101.96 157.05 17.14 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.872 -0.604 . . . . 73.41 109.487 173.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 17.8 m -58.18 -23.93 57.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.173 0.511 . . . . 63.14 110.86 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . 0.459 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.84 -35.39 91.85 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.588 -0.733 . . . . 51.42 113.199 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.603 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 14.9 mm-40 -70.16 -24.84 63.22 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 117.276 0.538 . . . . 64.22 110.342 -175.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.24 -41.47 22.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.737 -0.665 . . . . 74.32 110.289 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.0 t -62.11 -43.71 98.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 64.24 110.297 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.7 -33.02 74.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.961 -0.563 . . . . 64.42 110.983 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.411 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 50.4 m -65.54 -38.41 89.56 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.013 0.435 . . . . 54.51 110.084 179.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.596 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.4 t80 -65.24 -36.53 84.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.587 0.708 . . . . 75.44 109.501 176.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.664 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.0 ttm -66.41 -49.39 66.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.287 -0.87 . . . . 74.34 111.949 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.53 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 21.6 t-105 -62.92 -37.82 88.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 71.54 110.732 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.572 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.89 -36.87 85.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.176 -0.465 . . . . 55.33 111.304 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 54.5 tp -67.76 -33.65 75.26 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.046 0.45 . . . . 64.12 110.166 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.547 ' HB1' ' HA ' ' A' ' 77' ' ' LEU . . . -60.99 -48.17 83.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 72.13 110.988 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -67.87 -34.78 77.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.331 -0.395 . . . . 74.12 111.08 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -74.14 -38.01 63.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.074 -0.512 . . . . 74.44 110.726 -176.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -75.2 -28.39 59.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.659 0.244 . . . . 71.14 111.659 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.489 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.37 -15.6 62.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.286 0.565 . . . . 53.1 110.809 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -67.05 -33.99 76.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.451 -0.795 . . . . 75.0 110.561 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.45 ' CZ ' ' HA2' ' A' ' 30' ' ' GLY . 76.8 m-85 -78.68 -0.74 31.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.57 . . . . 72.03 112.044 -176.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . 0.533 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.93 -36.33 72.85 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.42 -0.895 . . . . 72.14 111.235 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . 0.804 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 5.1 m -68.37 -11.83 60.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.469 -0.365 . . . . 53.33 111.611 -178.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 27.1 p -105.85 1.77 27.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.964 0.411 . . . . 72.01 110.59 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 32.0 t -77.98 -43.2 30.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.952 -0.567 . . . . 55.23 111.198 -175.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.503 ' HD1' ' HG2' ' B' ' 253' ' ' GLU . 0.3 OUTLIER -144.0 -179.71 6.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.36 0.6 . . . . 63.5 112.561 -174.08 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.503 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 7.1 pt-20 -94.49 -47.53 6.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.74 -1.118 . . . . 74.34 111.872 -172.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 74.3 p -111.91 156.49 21.98 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 109.538 -0.541 . . . . 72.24 109.538 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.3 ptmt -68.02 -31.89 71.88 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.422 -0.511 . . . . 64.34 110.701 -177.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -65.98 -37.1 85.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.941 0.4 . . . . 52.51 111.044 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.523 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 26.1 mt-30 -90.55 -14.8 31.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.281 -0.418 . . . . 74.11 110.828 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.804 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.9 ttt -89.06 -40.17 13.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.942 -0.572 . . . . 74.11 110.541 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.488 ' O ' ' HD2' ' B' ' 262' ' ' LYS . 32.8 tt0 -63.02 -34.52 77.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 73.45 110.802 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.68 -3.63 19.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.352 -0.386 . . . . 71.34 110.709 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 73.3 mmtt -115.62 -9.65 11.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.323 -0.398 . . . . 61.32 112.055 -176.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.664 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 0.0 OUTLIER -64.5 -27.07 68.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 120.021 -0.671 . . . . 71.54 110.73 -173.133 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -83.36 -41.12 18.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 110.108 -0.33 . . . . 75.32 110.108 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -62.59 -42.42 99.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 75.5 111.836 -177.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.664 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 24.3 ptp -68.25 -29.84 68.75 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.085 -0.709 . . . . 71.42 109.085 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.557 ' HG2' HD22 ' A' ' 77' ' ' LEU . 52.5 mtp -75.86 -36.31 59.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.161 -0.927 . . . . 72.33 110.92 178.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.53 -31.76 72.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 75.52 111.001 -165.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.683 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 17.6 p90 -97.02 -11.98 23.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.222 -0.445 . . . . 71.34 110.984 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.415 ' HD1' ' HA ' ' B' ' 269' ' ' TYR . 2.5 m-30 -60.48 -47.66 85.18 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 110.135 -0.32 . . . . 51.33 110.135 177.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.568 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -49.68 -45.73 49.08 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.672 -0.694 . . . . 70.34 110.231 174.135 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -92.1 26.06 2.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.86 -1.064 . . . . 65.52 111.698 -169.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.683 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 3.6 mmp_? -97.87 -46.79 5.81 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.729 -0.607 . . . . 65.11 111.455 -177.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.76 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -89.64 10.78 21.88 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.329 -0.548 . . . . 74.43 110.547 -178.575 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.441 ' HE3' ' HG2' ' A' ' 70' ' ' MET . 29.4 ttmt -60.32 -53.94 51.59 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.702 -0.681 . . . . 74.21 110.454 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.52 -40.88 96.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 71.32 111.492 -176.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 60.5 mtm -73.74 -29.78 62.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 52.14 110.663 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 4.8 tt -72.6 -43.68 63.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 75.11 109.507 177.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.54 -27.86 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.815 -0.63 . . . . 72.43 110.821 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.4 57.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 52.2 111.548 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -95.39 -8.36 35.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.227 0.536 . . . . 74.1 110.274 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 20.6 mmt -73.74 178.06 5.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.619 -0.719 . . . . 75.31 111.226 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.748 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 40.4 mt-10 70.09 -5.22 1.34 Allowed 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 113.998 1.111 . . . . 63.35 113.998 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.28 -68.5 0.34 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.116 0.417 . . . . 73.42 110.586 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -60.4 -28.72 68.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.848 0.356 . . . . 71.35 110.832 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.748 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 61.9 mt -64.53 -55.04 23.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.564 . . . . 71.12 111.628 -176.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.7 pt-20 -63.12 -25.95 68.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.907 0.384 . . . . 75.03 111.29 -177.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -97.27 5.62 49.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.191 -0.459 . . . . 65.43 111.196 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -54.99 -52.85 61.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.648 0.24 . . . . 64.25 111.648 -176.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 . . . . . 0 C--N 1.327 -0.383 0 CA-C-O 120.638 0.256 . . . . 65.5 111.249 -177.104 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.449 -0.486 0 CA-C-O 120.921 0.391 . . . . 72.14 110.075 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.94 99.88 9.34 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 54.15 110.607 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 72.59 -60.77 0.52 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.333 -0.848 . . . . 72.2 111.537 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.1 154.55 29.28 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.892 -0.595 . . . . 34.05 111.65 -176.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.513 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -79.13 51.24 1.14 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.961 -1.018 . . . . 63.53 112.608 -175.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -54.03 -41.22 67.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.854 0.359 . . . . 72.04 111.154 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -4.77 34.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 35.43 112.361 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.46 ' NH2' ' HB3' ' B' ' 221' ' ' GLN . 60.7 mtp85 -99.86 -61.1 1.41 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.214 -0.291 . . . . 72.14 110.214 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.874 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.43 -22.49 12.73 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.77 0.656 . . . . 73.22 112.77 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.4 t -63.18 -22.71 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.706 0.289 . . . . 71.11 111.153 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.51 ' HB2' HD11 ' B' ' 217' ' ' LEU . 74.6 mt-10 -90.39 -28.08 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.075 0.464 . . . . 74.44 110.004 -178.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.874 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.8 mm? -62.39 -42.62 99.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 65.41 110.097 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.01 -23.21 21.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.506 -0.77 . . . . 73.03 111.093 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -64.22 -28.98 70.11 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 116.15 -0.477 . . . . 74.15 111.065 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 213' ' ' GLU . 2.1 tm? -74.52 -43.23 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.438 -0.579 . . . . 63.22 109.438 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.28 75.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.965 -0.562 . . . . 62.44 111.416 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -66.45 -18.38 65.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.431 -0.349 . . . . 65.02 111.768 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -23.63 51.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.431 0.634 . . . . 72.42 109.864 177.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -99.23 -11.91 20.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.733 -0.667 . . . . 73.04 110.07 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.859 ' HA ' HG21 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -86.57 -21.44 26.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.495 -0.775 . . . . 63.34 110.064 -177.792 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -80.67 18.94 0.87 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.185 -0.462 . . . . 74.33 111.998 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.566 HD22 HG13 ' A' ' 27' ' ' ILE . 1.7 t30 -82.74 107.2 15.19 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.121 -1.066 . . . . 63.43 108.121 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -59.64 -32.38 70.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.807 0.669 . . . . 63.01 112.807 -171.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -91.44 11.77 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.768 0.655 . . . . 73.34 112.768 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.566 HG13 HD22 ' A' ' 24' ' ' ASN . 4.2 mt -120.52 152.07 23.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.022 0.439 . . . . 65.22 110.7 176.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.677 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 47.0 mt-30 -73.65 152.9 40.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 73.34 110.143 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.616 HG23 HD21 ' A' ' 22' ' ' ASN . 13.5 m -65.25 -34.15 77.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.206 0.527 . . . . 74.43 110.841 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.1 -2.43 78.19 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.954 -0.566 . . . . 74.15 113.708 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.677 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 52.5 mm-40 -86.47 -12.03 50.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.502 0.651 . . . . 54.34 110.246 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.859 HG21 ' HA ' ' A' ' 22' ' ' ASN . 21.3 t -91.74 -36.88 8.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.793 -0.64 . . . . 73.24 111.181 -176.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.9 p -58.65 -31.39 68.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 62.03 110.955 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.11 79.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.796 -0.638 . . . . 62.43 111.274 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.8 m -66.65 -36.38 82.42 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.123 0.487 . . . . 63.31 110.051 -178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CD1' HD12 ' B' ' 214' ' ' LEU . 8.6 t80 -67.86 -35.54 78.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.761 -0.654 . . . . 62.12 109.509 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.597 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 11.5 ttt -66.48 -55.83 13.75 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.368 -0.833 . . . . 73.45 111.644 -178.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.62 ' CZ3' ' HB3' ' B' ' 276' ' ' MET . 16.7 t-105 -55.2 -41.1 71.53 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.283 -0.417 . . . . 73.3 111.142 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.454 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -60.72 -36.64 79.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.244 -0.434 . . . . 61.13 111.059 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.718 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.9 tp -69.69 -35.97 75.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 72.35 110.271 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.68 -49.92 75.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.774 -0.648 . . . . 32.11 111.306 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -80.21 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.51 -0.476 . . . . 70.31 111.297 -176.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -86.25 -39.49 16.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.402 -0.592 . . . . 75.3 109.402 175.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -72.81 -30.5 64.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 75.22 111.116 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.608 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -72.37 -17.06 61.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 72.22 111.104 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -56.14 -38.19 70.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.846 -0.616 . . . . 72.45 110.373 177.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.553 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 69.7 m-85 -76.17 -11.31 59.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.734 -0.666 . . . . 72.22 112.072 -177.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.43 -33.55 85.07 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.394 -0.908 . . . . 63.04 111.484 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.712 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 60.2 p -60.76 -37.86 83.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.98 0.419 . . . . 71.21 111.493 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.6 t -95.07 13.98 23.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.149 0.5 . . . . 51.35 110.842 -175.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.1 t -76.36 -39.26 54.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 75.01 111.728 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.664 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -140.07 -167.67 2.36 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.481 -0.487 . . . . 73.02 112.258 -176.418 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.65 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.0 pt-20 -104.59 -40.33 6.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.373 -0.831 . . . . 54.41 111.686 -174.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.5 p -118.02 162.64 17.83 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.877 -0.416 . . . . 70.22 109.877 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.61 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 18.4 ptmt -71.66 -35.33 70.32 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.642 -0.423 . . . . 72.04 110.797 -177.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -64.93 -42.84 94.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.31 -0.405 . . . . 72.22 111.118 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.548 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.3 mt-30 -77.18 -36.1 55.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.886 0.374 . . . . 73.34 110.36 178.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.712 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 15.9 ttt -63.25 -40.28 96.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.046 -0.525 . . . . 71.13 110.687 177.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.522 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.2 tt0 -62.11 -33.74 75.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.713 -0.676 . . . . 63.12 111.053 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.51 -1.61 38.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.353 -0.385 . . . . 53.24 111.421 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.664 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.9 mmmt -108.77 -0.38 19.98 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.408 -0.36 . . . . 71.43 111.413 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.624 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.0 ptpt -57.51 -50.81 71.86 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 123.3 0.375 . . . . 72.33 110.535 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.624 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -75.43 -14.17 60.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.428 -0.351 . . . . 75.52 110.623 -176.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -82.73 -44.86 15.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 73.5 111.431 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 3.9 ptt? -79.75 -22.49 43.17 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 119.914 -0.714 . . . . 73.14 109.617 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.475 ' HG2' HD22 ' B' ' 277' ' ' LEU . 56.9 mtp -89.44 -7.9 54.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.589 -0.732 . . . . 71.33 110.587 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -57.68 -45.47 85.56 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.166 0.508 . . . . 72.24 110.808 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.657 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 7.1 p90 -110.52 6.06 21.71 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.377 -0.829 . . . . 74.31 110.333 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.559 ' O ' ' HE1' ' B' ' 237' ' ' MET . 0.8 OUTLIER -63.16 -53.67 49.7 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.217 -0.66 . . . . 71.55 109.217 173.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.473 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -55.88 -45.2 78.63 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.092 -0.706 . . . . 74.33 109.092 174.228 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.412 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 7.5 t70 -96.84 57.08 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.852 -1.067 . . . . 61.31 110.93 -173.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 7.8 mmm180 -122.29 -46.57 2.17 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 120.999 0.428 . . . . 73.31 110.648 172.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.774 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -92.25 12.56 21.98 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.49 0.662 . . . . 70.02 109.455 -178.529 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.564 ' HG3' ' SD ' ' B' ' 270' ' ' MET . 65.0 tttt -60.63 -63.82 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.463 -1.244 . . . . 72.14 110.658 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.27 -37.4 83.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.057 -0.52 . . . . 62.12 111.289 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.478 ' HB3' ' CZ3' ' B' ' 238' ' ' TRP . 47.3 mtm -69.05 -31.5 70.32 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 74.21 110.407 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.538 HD22 ' HG2' ' B' ' 266' ' ' MET . 5.6 tt -73.56 -42.14 62.04 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.549 -0.537 . . . . 61.35 109.549 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.619 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 23.1 t70 -61.53 -35.27 77.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.818 -0.628 . . . . 64.11 110.329 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.32 -13.72 62.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.444 -0.798 . . . . 53.35 111.523 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -100.61 -21.38 15.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.071 0.462 . . . . 64.51 109.759 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.521 ' O ' HG13 ' A' ' 85' ' ' ILE . 20.8 mmt -68.21 -55.73 11.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.832 -0.622 . . . . 71.22 110.18 174.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 12.5 pt-20 -57.29 -26.06 60.25 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 115.556 -0.747 . . . . 75.1 111.278 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -53.04 -48.49 67.6 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.042 0.448 . . . . 73.53 110.409 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -84.15 -25.01 29.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.152 -0.476 . . . . 71.5 110.721 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 81' ' ' MET . 67.5 mt -69.47 -56.87 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 74.25 110.919 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.632 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.1 pt-20 -68.96 -19.74 64.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 53.04 111.163 -176.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -103.95 18.88 21.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.516 -0.311 . . . . 74.13 111.174 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 21.4 t80 -56.84 -54.67 43.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.98 -0.378 . . . . 72.42 109.98 177.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.372 -0.376 . . . . 74.3 111.399 -179.357 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 109.997 -0.372 . . . . 63.01 109.997 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 36.2 tt0 -78.93 81.55 5.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.129 -0.487 . . . . 71.41 110.854 -178.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 2.6 t30 72.64 -60.94 0.52 Allowed 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 124.107 0.963 . . . . 72.52 110.658 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -73.12 160.54 31.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.809 -0.632 . . . . 73.33 111.648 -176.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -82.25 49.47 1.42 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.338 -0.846 . . . . 73.14 111.805 -177.362 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.419 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 67.0 m-85 -53.21 -45.63 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.094 0.473 . . . . 54.41 110.735 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.97 -18.17 64.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.463 -0.79 . . . . 73.01 112.212 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.625 HH22 HG22 ' A' ' 32' ' ' VAL . 25.4 mtp180 -90.41 -62.27 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.156 -0.313 . . . . 63.15 110.156 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.823 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -54.16 -26.75 29.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.091 0.775 . . . . 63.41 113.091 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.5 t -65.58 -18.32 65.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.509 0.195 . . . . 75.31 111.188 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 21.2 mt-10 -96.49 -16.73 20.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.062 0.458 . . . . 73.15 110.391 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.823 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.9 mm? -69.11 -45.01 71.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.888 -0.782 . . . . 72.3 108.888 173.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.444 HG13 ' HB1' ' A' ' 39' ' ' ALA . 66.7 mt -69.2 -24.85 28.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.394 -0.821 . . . . 74.11 110.339 175.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.7 tmtp? -59.69 -35.71 75.03 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.678 -0.692 . . . . 72.33 110.709 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.75 HD12 HD13 ' A' ' 14' ' ' LEU . 3.0 tm? -71.41 -42.35 68.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.185 -0.672 . . . . 74.53 109.185 176.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.59 -39.07 86.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 75.23 111.04 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -61.22 -33.77 74.03 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.849 0.357 . . . . 74.31 111.074 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -34.78 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.459 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . 0.46 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 56.3 mt-30 -82.77 -17.34 44.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.364 0.602 . . . . 73.33 110.255 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . 0.722 HD21 HG23 ' B' ' 229' ' ' THR . 25.5 t-20 -76.25 -5.47 47.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.154 -0.93 . . . . 75.33 109.779 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -77.41 2.37 16.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 73.21 111.356 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.43 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -58.7 131.99 52.54 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.099 0.476 . . . . 71.3 110.262 175.721 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.8 t -94.69 -22.96 17.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.834 -0.621 . . . . 73.42 110.063 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . 0.468 ' HG2' HG13 ' B' ' 227' ' ' ILE . 1.5 pm0 -88.73 -21.82 23.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.65 -0.704 . . . . 71.53 111.455 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.468 HG13 ' HG2' ' B' ' 226' ' ' GLU . 6.3 mt -110.01 150.95 12.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.873 0.368 . . . . 75.42 110.619 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -93.44 175.56 6.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.836 -0.62 . . . . 54.51 110.193 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . 0.722 HG23 HD21 ' B' ' 222' ' ' ASN . 3.4 m -64.29 -31.56 72.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.156 -0.474 . . . . 71.53 111.588 -175.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . 0.553 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -61.5 -25.62 65.41 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 114.865 0.706 . . . . 71.5 114.865 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -88.06 -15.99 34.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.697 0.748 . . . . 63.42 111.635 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . 0.518 HG21 ' HA ' ' B' ' 222' ' ' ASN . 35.9 t -81.11 -37.4 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.963 -0.295 . . . . 64.1 110.896 -176.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 8.7 p -60.25 -34.64 73.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.286 0.565 . . . . 53.11 110.567 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.11 -32.02 72.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.751 . . . . 60.32 111.635 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 18.3 m -67.64 -32.81 73.76 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.137 0.494 . . . . 71.41 109.738 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.655 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 4.7 t80 -71.91 -34.81 69.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 74.33 109.239 177.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.774 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.9 tpt -60.41 -55.81 29.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 74.01 110.916 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.513 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 28.3 t-105 -63.87 -33.8 76.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.73 -0.668 . . . . 75.55 111.739 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.459 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.99 -39.61 93.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.597 -0.274 . . . . 63.3 111.16 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.462 HD21 ' HG3' ' A' ' 37' ' ' MET . 61.6 tp -68.19 -29.94 68.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.931 0.396 . . . . 74.34 110.416 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.09 -47.47 82.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.933 -0.576 . . . . 64.14 111.303 -178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -84.01 -5.97 59.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.846 -0.342 . . . . 65.15 110.902 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -89.37 -41.03 12.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.231 -0.655 . . . . 74.11 109.231 175.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -75.18 -36.73 61.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.791 -0.64 . . . . 72.24 111.761 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.409 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -68.01 -17.14 64.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.061 0.457 . . . . 71.34 111.021 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -68.05 -17.82 64.51 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 72.35 110.009 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -96.71 -0.06 48.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.124 -0.489 . . . . 75.04 111.206 177.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . 0.402 ' HA3' ' SD ' ' A' ' 81' ' ' MET . . . -75.8 -29.77 58.78 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.6 -0.81 . . . . 34.45 111.671 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 18.6 p -72.11 -18.12 61.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.865 0.365 . . . . 61.24 111.235 -177.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 15.3 t -103.95 16.79 25.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.538 0.685 . . . . 64.24 110.117 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 10.6 t -82.06 -44.21 16.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.585 -0.734 . . . . 72.2 110.329 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.724 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 0.4 OUTLIER -138.94 -172.37 3.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.471 -0.331 . . . . 61.54 111.159 -179.602 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -102.96 -44.57 5.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.11 111.592 -173.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 56.4 p -107.33 151.63 25.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.72 -0.218 . . . . 64.02 110.551 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.471 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 22.5 ptmt -63.27 -32.51 73.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.4 . . . . 65.53 110.636 -178.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -60.14 -54.17 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.859 -0.609 . . . . 62.52 110.299 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.665 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 22.3 mt-30 -71.4 -42.88 67.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.838 -0.619 . . . . 72.02 110.363 -178.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 14.5 ttt -57.27 -42.06 80.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 50.21 111.233 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -63.23 -33.02 74.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.061 -0.518 . . . . 72.52 111.245 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -78.3 -4.51 48.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.992 0.425 . . . . 44.43 111.061 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.724 ' HE2' ' HE2' ' B' ' 252' ' ' PHE . 27.1 mmmt -112.91 3.83 16.51 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.156 -176.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.651 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 17.3 ptpt -55.86 -52.97 62.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.073 -0.512 . . . . 54.13 110.647 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.651 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.0 tp60 -66.57 -30.55 70.88 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.529 -0.305 . . . . 70.4 110.789 -176.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.437 -0.347 . . . . 75.12 111.53 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.533 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 4.8 ptt? -79.47 -28.13 41.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 120.274 -0.57 . . . . 54.24 110.191 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.619 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 72.8 mtp -77.32 -24.24 50.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.718 -0.674 . . . . 44.14 111.613 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -66.19 -25.95 67.17 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.53 0.681 . . . . 50.13 109.214 -174.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 28.1 m-85 -94.29 -17.24 22.83 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.893 -1.048 . . . . 55.15 111.35 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.485 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.5 m-30 -72.55 -40.45 66.7 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.247 -1.02 . . . . 63.54 108.247 171.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.564 ' SD ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.75 -63.61 1.09 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.033 -0.531 . . . . 74.21 110.386 169.701 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -98.84 76.87 2.19 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.742 0.645 . . . . 74.11 112.742 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 4.5 mmm180 -152.87 -34.49 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.955 -0.566 . . . . 71.31 111.081 166.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.597 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.84 0.66 46.62 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 108.988 -0.745 . . . . 74.15 108.988 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -61.29 -52.58 64.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.806 -1.088 . . . . 74.51 110.827 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -58.91 -38.74 79.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.192 0.52 . . . . 65.21 111.129 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . 0.62 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 55.2 mtm -80.34 -24.69 39.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.836 -0.62 . . . . 63.31 110.427 -177.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.475 HD22 ' HG2' ' A' ' 66' ' ' MET . 4.9 tt -72.42 -43.45 63.84 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.814 -0.81 . . . . 73.41 108.814 174.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.93 -39.85 75.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.085 -0.962 . . . . 64.44 110.291 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -61.91 -24.03 66.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.091 -0.958 . . . . 71.34 112.008 -177.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -98.4 -13.98 20.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.913 0.387 . . . . 64.03 110.516 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.608 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 16.1 mmt -69.66 -55.21 10.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.934 -0.575 . . . . 74.41 110.786 178.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.573 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 7.3 pt-20 -78.61 0.76 25.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.942 -0.572 . . . . 64.55 112.495 -174.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.73 -45.92 92.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.278 0.561 . . . . 71.21 109.601 173.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -82.37 -19.72 38.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.543 -0.753 . . . . 72.42 110.471 177.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.545 ' CG1' ' HA ' ' B' ' 282' ' ' GLU . 68.6 mt -71.87 -55.29 13.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 120.905 0.384 . . . . 74.11 110.572 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -65.78 -18.53 65.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 64.45 110.937 -178.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . 0.42 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 57.8 m-80 -112.32 18.9 18.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.446 -0.343 . . . . 70.52 111.462 179.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.61 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 26.4 t80 -53.59 -54.6 35.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.699 0.285 . . . . 73.23 110.833 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.329 -0.396 . . . . 71.24 111.246 -178.481 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 CA--C 1.519 -0.216 0 N-CA-C 110.083 -0.34 . . . . 63.04 110.083 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.561 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . 3.3 tm-20 -65.28 -43.96 89.54 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.314 -0.995 . . . . 72.43 108.314 169.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.635 ' H ' ' HE2' ' A' ' 8' ' ' TYR . 9.1 t30 -148.04 -30.33 0.3 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.906 -1.043 . . . . 64.33 109.767 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.46 -162.75 1.62 Allowed 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 112.511 0.56 . . . . 71.43 112.511 -173.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.459 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.6 OUTLIER -71.58 42.33 0.08 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.097 1.359 . . . . 51.22 114.312 -172.396 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.635 ' HE2' ' H ' ' A' ' 5' ' ' ASN . 75.2 m-85 -57.9 -41.5 82.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 118.009 0.368 . . . . 73.34 111.469 -176.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.46 -18.96 65.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 64.4 111.913 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -92.93 -52.8 4.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.525 0.194 . . . . 74.13 111.525 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.812 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.6 -25.02 23.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.552 0.575 . . . . 73.41 112.552 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.9 t -68.13 -23.0 64.84 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.674 0.273 . . . . 65.32 111.028 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.6 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.3 mt-10 -79.19 -27.22 42.59 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.361 0.6 . . . . 73.11 109.392 -178.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.812 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -65.75 -48.98 70.04 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.033 -0.985 . . . . 75.11 109.597 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.502 HG23 ' HD2' ' B' ' 243' ' ' TYR . 81.4 mt -67.82 -29.44 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.587 -0.733 . . . . 63.52 110.198 176.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.429 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.3 tmmt? -60.18 -30.5 69.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.732 -0.667 . . . . 63.44 111.023 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.423 HD12 HD13 ' B' ' 214' ' ' LEU . 3.0 tm? -69.32 -45.23 70.01 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.29 -0.633 . . . . 74.43 109.29 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -32.27 72.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.636 -0.711 . . . . 64.01 110.921 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.604 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.6 m-20 -56.01 -35.72 67.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.071 -0.513 . . . . 74.43 110.624 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.54 -37.95 65.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 72.43 111.122 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -74.13 -22.36 59.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.918 0.389 . . . . 73.44 110.849 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -79.71 -12.71 59.79 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.185 0.517 . . . . 71.32 109.872 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.604 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 78.1 mm-40 -81.9 -4.85 57.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.97 -0.559 . . . . 54.41 110.328 175.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.573 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.6 t30 -80.03 135.01 36.26 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.256 0.55 . . . . 70.13 110.61 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.402 ' H ' HG22 ' A' ' 25' ' ' THR . 3.4 t -74.98 -36.39 62.03 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.228 -0.896 . . . . 70.13 111.84 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.58 -23.56 56.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 74.35 111.602 -174.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.573 HG13 ' HB3' ' A' ' 24' ' ' ASN . 2.5 mt -97.12 163.43 2.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.867 0.365 . . . . 70.11 110.262 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -119.8 163.52 17.37 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.845 -0.616 . . . . 72.1 109.392 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -54.65 -32.21 58.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.933 0.397 . . . . 73.03 111.509 -176.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.54 -42.21 99.72 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.232 -0.508 . . . . 65.54 113.473 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HB2' HG22 ' A' ' 27' ' ' ILE . 21.0 mm-40 -73.04 -37.82 66.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.127 0.463 . . . . 72.11 111.221 -173.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -69.12 -36.99 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.193 0.52 . . . . 73.35 110.657 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 m -74.94 -40.01 61.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.091 0.472 . . . . 43.31 110.705 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.95 -30.33 63.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 73.22 111.867 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.494 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 11.0 p -66.98 -30.75 70.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.6 0.238 . . . . 74.0 110.727 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.548 ' CD1' HD12 ' B' ' 214' ' ' LEU . 4.9 t80 -66.16 -33.58 76.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.16 0.505 . . . . 63.31 109.772 177.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.544 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.8 ttm -70.54 -47.49 60.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.861 -0.609 . . . . 74.13 111.104 178.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -63.3 -37.89 89.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.931 0.396 . . . . 72.34 110.616 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.95 -36.8 84.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.197 -0.456 . . . . 72.12 111.196 179.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.605 HD21 ' SD ' ' B' ' 237' ' ' MET . 52.3 tp -66.62 -32.4 73.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.001 0.429 . . . . 63.31 110.022 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -66.91 -46.25 75.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.795 -0.639 . . . . 54.33 110.704 177.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.3 mtp180 -69.05 -25.11 64.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.896 0.379 . . . . 64.01 110.949 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.411 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 10.5 t80 -84.29 -45.03 13.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 72.35 111.057 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -68.51 -28.39 66.96 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.081 0.4 . . . . 54.4 112.081 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.14 60.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.998 0.428 . . . . 72.42 111.054 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.411 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 22.3 t90 -66.94 -17.67 65.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.639 0.733 . . . . 72.3 110.047 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.433 ' CZ ' HG22 ' B' ' 229' ' ' THR . 83.0 m-85 -93.3 0.32 56.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.761 -0.654 . . . . 64.45 111.156 177.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -73.46 -37.05 53.92 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.454 -0.879 . . . . 25.24 111.323 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -73.03 -0.21 13.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.954 0.407 . . . . 61.41 111.574 -177.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.7 t -123.53 17.55 9.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.338 0.59 . . . . 73.23 109.486 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.9 t -93.93 -31.43 14.29 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.813 -0.63 . . . . 63.51 110.867 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.712 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -143.29 -174.29 4.17 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 120.947 0.403 . . . . 70.33 111.368 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.678 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 7.7 pt-20 -98.54 -41.4 7.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.573 -0.74 . . . . 54.32 111.383 -173.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 82.7 p -120.93 161.84 20.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.094 -0.336 . . . . 70.42 110.094 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 22.2 ptmt -72.88 -34.57 66.78 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.918 -0.313 . . . . 74.23 110.538 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.14 -31.99 73.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.168 -0.469 . . . . 71.43 110.386 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.666 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 20.2 mt-30 -90.48 -37.72 13.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.007 -0.542 . . . . 73.15 110.464 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.462 ' HE2' ' CG1' ' B' ' 285' ' ' ILE . 10.5 ttt -61.81 -42.41 98.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.288 -0.414 . . . . 71.34 110.988 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.85 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.001 -0.545 . . . . 64.43 110.991 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.07 -6.73 58.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 51.4 111.27 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.712 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 30.2 mmmt -108.56 4.37 23.99 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 116.486 -0.325 . . . . 73.41 110.79 -178.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 65' ' ' MET . 18.3 ptpt -53.72 -45.05 70.35 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.338 0.399 . . . . 75.42 111.017 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 8.5 tp60 -79.9 -14.18 58.82 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.882 -0.327 . . . . 64.21 110.654 -176.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -93.37 -6.67 46.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.393 -0.367 . . . . 72.23 110.929 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 20.5 ptp -106.39 -25.05 12.07 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.323 -0.621 . . . . 74.32 109.323 169.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.516 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 82.2 mtp -94.02 -0.47 55.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.449 -0.796 . . . . 65.35 112.498 -175.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.26 -33.08 59.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.7 0.762 . . . . 72.23 109.34 -175.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.648 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 10.8 m-85 -84.27 -16.14 44.21 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.754 -1.112 . . . . 71.31 110.913 175.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.63 ' CD2' HD21 ' B' ' 277' ' ' LEU . 13.8 m-30 -73.66 -42.21 61.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.263 -0.426 . . . . 61.3 109.981 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -74.72 -56.71 4.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.279 -0.569 . . . . 61.14 109.804 170.485 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -102.67 83.73 2.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.09 -0.504 . . . . 64.31 112.354 -171.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.648 ' HB2' ' O ' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -164.16 -36.93 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.092 -0.504 . . . . 74.3 111.059 169.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.436 ' HE2' ' HG ' ' B' ' 240' ' ' LEU . 0.1 OUTLIER -86.87 7.84 25.5 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.834 0.826 . . . . 74.23 108.838 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.429 ' HE2' HE22 ' B' ' 263' ' ' GLN . 47.6 tttm -62.64 -54.52 38.33 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.318 -1.31 . . . . 75.11 110.172 175.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -58.92 -35.57 73.3 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.147 -0.479 . . . . 72.02 110.625 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.408 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 50.6 mtt -67.28 -36.75 82.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.617 -0.719 . . . . 74.01 109.974 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 0.9 OUTLIER -75.47 -40.9 56.8 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.264 -0.88 . . . . 64.0 110.224 -178.442 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.414 ' N ' ' HE1' ' B' ' 266' ' ' MET . 3.8 m-20 -53.71 -38.94 64.78 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.315 0.579 . . . . 72.21 110.175 174.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -31.57 71.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.038 -0.983 . . . . 61.51 111.523 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.519 HD21 ' HG2' ' B' ' 242' ' ' ARG . 42.8 m-80 -85.09 -32.5 22.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.741 -0.466 . . . . 75.53 109.741 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.502 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.6 mmt -62.39 -62.17 1.94 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 61.4 110.475 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 24.6 mm-40 -54.1 -31.7 52.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 64.42 111.334 -178.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.45 -46.44 80.34 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.346 0.404 . . . . 60.01 111.328 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -82.53 -28.98 30.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 60.35 110.695 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.518 HG21 ' HB2' ' B' ' 259' ' ' GLN . 87.3 mt -67.91 -53.48 30.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 71.44 111.549 -178.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.4 pt-20 -65.32 -25.69 67.72 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.788 0.328 . . . . 73.32 111.093 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.8 m-80 -102.83 14.94 30.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.553 -0.294 . . . . 72.35 111.212 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.545 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 62.1 t80 -53.24 -53.83 45.08 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.025 0.203 . . . . 75.35 111.328 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 . . . . . 0 C--N 1.326 -0.448 0 CA-C-O 120.834 0.349 . . . . 73.04 110.329 -177.06 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 110.661 -0.125 . . . . 75.14 110.661 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.02 -70.09 0.21 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.484 -0.562 . . . . 65.34 109.484 170.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -142.56 9.6 1.81 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.903 0.859 . . . . 62.03 109.124 174.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.586 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -124.58 170.37 10.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 74.53 111.875 -171.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.494 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -86.59 38.04 0.77 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.423 -0.808 . . . . 75.13 112.061 -175.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.586 ' CE2' ' HB3' ' B' ' 206' ' ' ALA . 65.0 m-85 -52.63 -55.71 20.54 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.687 0.254 . . . . 71.4 111.687 -177.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.69 -18.46 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.066 -0.515 . . . . 70.21 112.338 -178.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -86.79 -54.49 4.33 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.146 -0.222 . . . . 72.31 110.662 178.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.651 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.1 -28.32 51.68 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.432 0.53 . . . . 70.13 112.432 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 12.5 t -70.34 -16.4 62.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 120.759 -0.376 . . . . 64.13 111.264 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 36.8 mt-10 -82.96 -29.23 29.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.837 -0.801 . . . . 74.21 108.837 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.0 -44.8 79.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.903 -1.044 . . . . 74.22 108.95 176.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.62 -27.39 33.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.39 -0.823 . . . . 61.32 110.512 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.0 OUTLIER -57.52 -38.63 74.99 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.259 -0.428 . . . . 40.45 110.982 -179.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.6 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -70.16 -42.59 72.31 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.224 -0.658 . . . . 71.42 109.224 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . 0.474 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -60.03 -42.43 94.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.058 -0.519 . . . . 63.42 110.731 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.568 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.4 m-20 -56.24 -34.22 66.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.235 -0.439 . . . . 62.4 110.587 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.33 -34.08 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.007 -0.542 . . . . 73.35 111.297 -178.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -75.39 -25.91 58.01 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.213 0.53 . . . . 72.22 110.495 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . 0.427 ' HA ' HG21 ' B' ' 232' ' ' VAL . 2.9 t-20 -68.27 -21.4 64.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.51 -0.768 . . . . 72.13 109.125 177.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 60.1 mm-40 -85.32 0.68 51.27 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.383 -0.826 . . . . 62.34 111.077 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.718 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 33.5 t30 -78.01 123.15 26.48 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 109.691 -0.485 . . . . 71.13 109.691 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.3 t -54.98 -26.01 33.77 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.91 -1.041 . . . . 73.54 113.434 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -105.08 9.05 34.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.381 0.512 . . . . 73.32 112.381 -173.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.718 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 6.2 mm -108.16 152.14 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.397 0.618 . . . . 75.24 111.306 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.548 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 32.8 mt-30 -92.11 152.13 20.07 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.143 -0.935 . . . . 54.03 108.596 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . 0.433 HG22 ' CZ ' ' A' ' 47' ' ' PHE . 16.8 m -56.46 -38.22 71.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.922 0.392 . . . . 72.21 110.755 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.28 -0.18 76.78 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.216 -0.516 . . . . 65.34 113.964 -176.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.548 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 42.1 mt-10 -90.02 -27.42 19.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.862 0.831 . . . . 71.51 110.406 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . 0.474 HG11 ' O ' ' B' ' 218' ' ' ALA . 12.1 t -76.94 -23.94 15.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.741 -0.663 . . . . 75.2 110.682 -176.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.5 p -77.46 -32.61 54.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.368 0.604 . . . . 52.04 109.806 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.71 65.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.529 -0.759 . . . . 50.2 111.044 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.459 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 16.8 p -66.86 -37.11 83.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.706 0.288 . . . . 53.3 110.334 177.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.563 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.13 -37.71 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.424 0.631 . . . . 55.14 109.323 175.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.605 ' SD ' HD21 ' A' ' 40' ' ' LEU . 10.7 tpt -58.07 -59.77 4.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.924 -1.034 . . . . 54.15 111.006 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.408 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 13.6 t-105 -59.43 -37.14 77.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 74.21 111.593 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.08 93.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.374 -0.375 . . . . 71.13 111.34 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.501 HD13 ' HB3' ' A' ' 36' ' ' PHE . 53.7 tp -68.77 -33.52 74.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.29 -0.263 . . . . 75.42 110.29 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.434 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.51 -35.42 75.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 71.24 111.104 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . 0.519 ' HG2' HD21 ' A' ' 80' ' ' ASN . 34.5 mtp180 -80.44 -45.87 16.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.181 -0.463 . . . . 72.21 110.742 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.502 ' HD2' HG23 ' A' ' 15' ' ' ILE . 12.2 t80 -68.52 -40.32 80.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.112 -0.495 . . . . 54.45 111.315 -174.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -64.73 -35.09 79.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.159 0.504 . . . . 71.25 110.931 -175.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -68.4 -2.04 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.871 -0.604 . . . . 64.43 112.242 -177.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -64.16 -26.92 68.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.218 0.532 . . . . 74.13 110.115 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -81.76 -5.27 58.0 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.134 -0.354 . . . . 75.32 111.13 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -71.03 -40.55 62.1 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.643 -0.789 . . . . 53.01 111.999 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 4.5 p -70.04 -14.25 62.59 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.869 0.322 . . . . 54.14 111.869 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.0 t -111.19 19.68 18.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.364 0.602 . . . . 72.22 110.022 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 8.2 t -84.94 -43.79 13.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.032 -0.531 . . . . 72.44 111.29 -176.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.577 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -143.2 -177.65 5.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.362 0.601 . . . . 75.04 112.353 -176.01 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.498 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 9.6 pt-20 -92.32 -37.03 12.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.973 -1.012 . . . . 74.33 111.832 -171.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.7 p -126.47 161.28 28.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.38 -0.23 . . . . 62.51 110.38 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.545 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 17.0 ptmt -64.14 -39.02 93.12 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 70.2 111.067 -177.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' B' ' 255' ' ' LYS . 37.1 mt-10 -59.89 -47.4 85.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.088 0.471 . . . . 75.24 111.026 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.677 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.8 mt-30 -80.48 -30.04 37.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.967 -0.56 . . . . 55.43 110.421 -176.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 14.0 ttt -67.03 -45.04 78.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 73.43 110.398 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.518 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.2 tt0 -63.03 -32.55 73.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.701 -0.681 . . . . 74.34 111.064 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -72.9 -11.33 60.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.178 -0.464 . . . . 74.24 111.055 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -107.1 -4.13 19.22 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 110.059 -0.348 . . . . 74.12 110.059 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.524 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 36.4 ttpt -52.3 -56.29 15.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.761 -0.654 . . . . 65.22 110.686 -177.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.429 HE22 ' HE2' ' A' ' 74' ' ' LYS . 15.2 tp60 -64.74 -30.92 71.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 75.21 111.004 -178.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -70.12 -45.48 66.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.329 -0.396 . . . . 74.22 111.909 -176.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.524 ' CE ' ' HA ' ' B' ' 262' ' ' LYS . 3.0 ptt? -77.73 -24.43 49.12 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 119.734 -0.786 . . . . 54.42 109.542 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.474 ' HA ' ' CD2' ' B' ' 269' ' ' TYR . 84.5 mtp -79.61 -13.39 59.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.591 -0.731 . . . . 71.22 111.431 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.17 -30.07 69.1 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.484 -0.932 . . . . 72.03 108.484 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.469 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 21.8 m-85 -93.7 -10.22 35.12 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.332 -1.304 . . . . 75.21 111.486 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.474 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 20.2 m-30 -79.82 -40.73 27.91 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.281 -1.007 . . . . 75.44 108.281 172.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.474 ' HE3' ' N ' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.7 -59.01 3.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.087 -0.506 . . . . 53.1 110.199 170.026 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.16 83.65 2.0 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.168 0.433 . . . . 75.4 112.168 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 9.7 mmm180 -154.04 -30.02 0.12 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.972 -0.558 . . . . 72.22 110.903 166.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.544 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -90.52 6.44 43.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.619 -0.882 . . . . 75.1 108.619 177.039 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.581 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 85.2 tttt -61.82 -53.5 55.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.564 -1.198 . . . . 74.22 110.248 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' B' ' 275' ' ' GLU . 5.2 pt-20 -69.41 -33.61 73.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.055 -0.52 . . . . 53.23 110.9 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.0 mtt -61.62 -38.93 89.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.608 0.718 . . . . 73.43 109.706 173.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.63 HD21 ' CD2' ' A' ' 69' ' ' TYR . 22.6 tp -71.37 -46.07 61.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.687 -1.142 . . . . 74.14 110.786 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.96 -40.23 80.07 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.271 0.558 . . . . 75.41 110.486 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.54 -30.72 71.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.156 -0.929 . . . . 72.51 111.196 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -86.31 -29.26 23.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 62.31 110.508 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.568 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -61.26 -55.42 32.11 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.879 -0.415 . . . . 73.31 109.879 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.611 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 71.7 mm-40 -52.98 -30.63 36.16 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.515 -0.766 . . . . 45.2 111.799 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -54.52 -51.36 65.39 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.396 0.435 . . . . 72.22 111.133 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -80.22 -28.65 38.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.356 -0.384 . . . . 75.31 111.156 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.568 HG13 ' O ' ' B' ' 281' ' ' MET . 76.3 mt -63.98 -53.56 42.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.823 0.344 . . . . 54.51 110.895 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.9 pt-20 -63.18 -29.01 70.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.42 -0.355 . . . . 51.24 111.201 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . 0.463 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 61.6 m-80 -102.02 15.37 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.528 -0.305 . . . . 71.1 111.417 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.449 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 27.0 t80 -53.22 -57.6 9.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.683 0.278 . . . . 73.52 111.02 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 28.0 t70 . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.297 -0.41 . . . . 70.15 110.583 -175.985 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.667 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.3 p-10 . . . . . 0 N--CA 1.452 -0.368 0 CA-C-O 121.054 0.454 . . . . 64.12 110.767 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -83.51 -80.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.993 -0.549 . . . . 74.02 110.169 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -105.16 -53.74 2.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.07 0.462 . . . . 74.43 109.94 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.667 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -82.52 161.9 22.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.895 -0.593 . . . . 71.2 110.808 177.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.471 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -80.41 55.14 2.19 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.895 -0.593 . . . . 73.21 112.181 -178.252 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -53.02 -42.65 65.86 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.334 -0.394 . . . . 74.33 111.844 -176.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' HG22 ' A' ' 12' ' ' THR . . . -63.35 -28.39 69.97 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.136 0.421 . . . . 70.11 112.136 -176.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -80.81 -62.98 1.51 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 121.174 -0.21 . . . . 74.51 110.608 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.91 -22.41 10.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.778 0.659 . . . . 54.45 112.778 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 9' ' ' ALA . 1.9 t -70.02 -25.82 63.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.464 0.173 . . . . 64.41 110.992 -176.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.488 ' CB ' HD11 ' B' ' 217' ' ' LEU . 29.9 mt-10 -76.73 -35.5 57.74 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.373 0.606 . . . . 72.42 109.401 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.655 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.0 mm? -61.11 -49.81 75.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.612 -1.176 . . . . 71.43 109.694 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.726 HG23 ' HD1' ' B' ' 243' ' ' TYR . 91.2 mt -63.36 -39.84 86.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.616 -0.72 . . . . 63.45 110.858 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 tmmt? -62.02 -31.37 71.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.618 -0.719 . . . . 74.0 111.516 -176.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.525 HD12 HD13 ' B' ' 214' ' ' LEU . 3.0 tm? -64.68 -42.54 95.28 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.981 -0.748 . . . . 51.43 108.981 177.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.72 -30.79 71.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.403 -0.817 . . . . 41.03 110.948 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.437 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -62.57 -35.26 78.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.212 -0.449 . . . . 75.31 110.749 179.437 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -70.57 -23.25 62.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.197 -0.456 . . . . 53.23 111.23 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -88.17 -27.29 21.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.247 0.546 . . . . 75.21 110.351 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.26 0.51 24.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 73.15 110.33 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 48.8 mt-30 -77.46 -11.81 59.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 74.11 111.197 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.436 HD22 ' HG2' ' A' ' 26' ' ' GLU . 1.8 t30 -66.04 114.14 4.98 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.462 -0.57 . . . . 75.11 109.462 178.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.437 ' H ' HG22 ' A' ' 25' ' ' THR . 3.8 t -77.45 58.06 1.64 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.318 -0.856 . . . . 64.24 112.272 -172.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.436 ' HG2' HD22 ' A' ' 24' ' ' ASN . 11.5 pt-20 -178.0 -22.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 75.23 111.441 176.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.432 HG13 ' HB3' ' A' ' 24' ' ' ASN . 9.7 mt -84.36 148.77 4.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 72.45 110.31 -177.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.709 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -72.76 145.38 47.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 61.14 109.704 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.0 m -63.39 -25.26 68.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.252 0.549 . . . . 75.34 109.843 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.03 -17.37 78.59 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 115.462 -0.79 . . . . 73.41 112.823 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.709 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 16.3 mm-40 -79.04 -22.62 45.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.417 0.627 . . . . 74.02 109.567 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -83.53 -42.44 17.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.417 -0.811 . . . . 74.01 110.088 179.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 p -62.1 -35.94 80.22 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.988 0.423 . . . . 73.14 110.177 176.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.13 -33.33 75.75 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.978 -0.555 . . . . 75.41 110.786 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.7 m -68.46 -36.35 78.88 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.509 -0.552 . . . . 72.52 109.509 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.655 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.7 t80 -69.94 -35.05 74.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.472 -0.785 . . . . 63.22 109.49 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 1.013 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.8 tpt -62.35 -56.79 14.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.08 -0.964 . . . . 73.03 110.563 179.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.406 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.637 -0.71 . . . . 72.14 111.335 177.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.05 99.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.404 -0.362 . . . . 60.42 111.102 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.9 -38.51 91.25 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 110.021 -0.362 . . . . 74.22 110.021 176.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.429 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -61.71 -45.86 92.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.233 -0.439 . . . . 72.13 111.041 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG3' ' OD1' ' B' ' 280' ' ' ASN . 39.9 ttt180 -74.27 -18.69 60.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.383 -0.371 . . . . 74.32 110.923 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.482 ' HD2' HG23 ' B' ' 215' ' ' ILE . 14.2 t80 -90.57 -35.35 15.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.136 0.494 . . . . 75.25 110.346 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -74.85 -39.24 61.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.915 -0.584 . . . . 70.15 111.185 -175.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.474 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -65.59 -18.21 65.15 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.035 0.445 . . . . 62.44 111.531 -178.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . 0.572 ' CH2' HG21 ' B' ' 229' ' ' THR . 16.7 t90 -63.67 -23.68 67.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.652 -0.703 . . . . 73.1 110.466 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.469 ' O ' HG22 ' A' ' 50' ' ' THR . 42.6 m-85 -93.61 9.71 35.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.219 -0.446 . . . . 72.5 111.075 178.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -76.74 -24.0 68.37 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.093 -1.051 . . . . 71.23 110.633 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.982 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 14.8 m -72.38 -12.96 61.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.186 -0.507 . . . . 71.45 111.843 -177.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.8 t -104.14 6.77 35.98 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.292 0.568 . . . . 75.1 110.612 -178.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.6 m -86.77 -24.78 24.96 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 112.935 0.717 . . . . 62.32 112.935 -175.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.547 ' HD1' ' H ' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -150.72 -172.31 4.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 122.095 -0.378 . . . . 63.05 111.22 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.547 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 9.6 pt-20 -110.85 -35.61 5.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.223 -0.444 . . . . 64.11 112.197 -173.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.3 p -115.15 155.56 26.9 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.094 -0.336 . . . . 53.21 110.094 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.631 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 21.9 ptmt -66.65 -37.93 85.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.738 0.304 . . . . 62.51 110.816 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -69.69 -27.67 65.21 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.07 -0.514 . . . . 73.12 111.32 -174.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.617 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.2 mt-30 -94.05 -32.47 13.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.448 -0.342 . . . . 74.55 110.652 178.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.982 ' HE1' ' HA ' ' A' ' 49' ' ' SER . 16.6 ttp -72.57 -35.53 67.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.991 0.424 . . . . 74.01 110.497 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.57 ' HB2' HG21 ' B' ' 285' ' ' ILE . 35.2 tt0 -62.1 -37.55 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 75.14 110.654 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.69 -2.2 25.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.912 -0.585 . . . . 71.21 110.998 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 32.1 mmmt -110.81 0.39 17.26 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 116.32 -0.4 . . . . 74.23 110.953 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.76 ' HG3' ' H ' ' A' ' 63' ' ' GLN . 12.9 ptpt -54.97 -56.9 14.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.836 0.35 . . . . 62.24 110.367 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.76 ' H ' ' HG3' ' A' ' 62' ' ' LYS . 14.2 tp60 -74.49 -20.13 60.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.249 -0.432 . . . . 73.03 109.843 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -79.69 -36.26 37.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.754 -0.657 . . . . 74.34 111.434 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 20.8 ptp -79.27 -27.01 42.29 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.112 -1.069 . . . . 55.05 108.112 178.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.42 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 76.7 mtp -79.36 -17.46 54.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.864 -1.062 . . . . 65.44 110.477 175.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -58.56 -35.01 71.68 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.318 0.58 . . . . 53.22 110.819 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.745 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 14.8 p90 -108.92 -5.69 16.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.75 -0.659 . . . . 75.11 110.576 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.683 ' HD2' HD21 ' B' ' 277' ' ' LEU . 2.2 m-30 -60.52 -51.95 67.27 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 110.469 -0.197 . . . . 75.35 110.469 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 1.038 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.25 -43.36 70.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.629 0.728 . . . . 75.45 109.599 172.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.0 33.98 0.86 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.798 -1.092 . . . . 71.25 112.066 -171.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.745 ' HG3' ' O ' ' A' ' 68' ' ' TYR . 35.2 mtp180 -105.85 -43.2 4.94 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.626 -0.671 . . . . 71.14 110.958 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.829 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -91.57 6.93 43.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.817 -0.353 . . . . 74.24 111.127 -175.179 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -60.88 -53.16 60.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 74.2 110.461 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -57.52 -34.32 68.99 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.192 0.52 . . . . 60.23 110.882 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.8 mtt -68.28 -37.1 80.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 74.43 109.922 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.557 ' HB3' ' CE ' ' B' ' 266' ' ' MET . 0.4 OUTLIER -73.0 -43.4 62.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.194 -0.912 . . . . 75.12 110.407 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.417 ' N ' ' HE1' ' B' ' 266' ' ' MET . 3.3 m-20 -55.31 -39.02 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.449 0.643 . . . . 74.24 110.634 178.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.69 -22.49 53.88 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.121 -0.945 . . . . 75.41 112.269 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.478 ' OD1' ' HG3' ' B' ' 242' ' ' ARG . 20.2 m-80 -94.29 -8.67 38.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.446 -0.502 . . . . 63.41 111.854 -174.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.456 ' HE3' ' HA ' ' B' ' 245' ' ' ALA . 44.2 mtt -88.94 -175.24 4.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.216 0.532 . . . . 74.12 111.278 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.665 ' HA ' HD12 ' A' ' 85' ' ' ILE . 36.2 mt-10 69.8 -5.1 1.29 Allowed 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.668 -1.151 . . . . 62.02 113.207 177.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.02 -56.97 15.1 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.074 0.464 . . . . 74.33 110.703 178.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -73.78 -21.73 60.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 55.32 110.904 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.7 mt -67.52 -57.79 8.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.404 -0.362 . . . . 65.12 110.407 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 23.9 pt-20 -62.8 -26.43 68.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 72.02 111.292 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -98.49 1.45 46.67 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.996 0.369 . . . . 41.21 111.996 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -59.23 -40.57 86.29 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.981 -0.377 . . . . 62.25 109.981 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.62 -0.718 . . . . 74.34 109.962 174.875 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.562 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.0 p-10 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 110.111 -0.329 . . . . 62.12 110.111 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -85.69 -113.49 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.418 -0.356 . . . . 72.44 110.512 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -91.89 -13.7 30.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.857 0.837 . . . . 50.25 109.184 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -107.55 150.44 26.85 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.101 -0.954 . . . . 61.14 110.471 176.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.455 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.1 OUTLIER -76.14 50.93 0.64 Allowed 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.939 -1.028 . . . . 63.24 112.486 -177.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.473 ' CZ ' ' HB3' ' B' ' 206' ' ' ALA . 63.5 m-85 -53.87 -44.28 70.26 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.725 0.298 . . . . 73.52 111.536 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -72.08 -9.04 57.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.147 -0.479 . . . . 74.13 111.86 -175.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 74.1 mtt180 -99.08 -59.31 1.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.928 -0.397 . . . . 71.45 109.928 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.736 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.12 -23.72 22.41 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.868 0.692 . . . . 71.21 112.868 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 9.3 t -65.05 -25.43 67.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.499 0.185 . . . . 74.44 111.499 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.484 ' HB2' HD11 ' A' ' 17' ' ' LEU . 39.1 mt-10 -80.52 -26.39 38.13 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.359 0.6 . . . . 61.21 109.845 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.736 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.2 mm? -68.18 -47.77 67.07 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.061 -0.972 . . . . 75.23 109.341 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.482 HG23 ' HD2' ' A' ' 43' ' ' TYR . 82.1 mt -66.5 -33.01 60.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-N 115.839 -0.619 . . . . 63.23 110.415 175.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.436 ' HE2' ' HB3' ' B' ' 216' ' ' LYS . 5.0 tmmm? -57.84 -36.37 72.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.529 -0.76 . . . . 73.05 110.797 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.488 HD11 ' CB ' ' A' ' 13' ' ' GLU . 2.5 tm? -66.95 -41.68 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.668 -0.493 . . . . 74.25 109.668 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.39 -31.74 69.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 64.55 110.94 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -33.32 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.141 -0.481 . . . . 62.15 111.12 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.06 -24.75 47.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.126 -0.488 . . . . 72.21 111.764 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -91.01 -17.06 26.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.395 0.617 . . . . 74.32 110.114 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -85.92 8.79 18.98 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.259 -0.882 . . . . 74.13 110.257 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -84.18 10.05 11.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.947 -0.569 . . . . 71.54 111.217 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.465 HD22 ' CG ' ' B' ' 226' ' ' GLU . 0.8 OUTLIER -88.41 108.27 19.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.955 0.407 . . . . 73.21 110.763 177.83 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -74.39 -25.23 59.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.725 -0.671 . . . . 70.04 110.885 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . 0.465 ' CG ' HD22 ' B' ' 224' ' ' ASN . 11.1 pt-20 -82.2 -6.0 58.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.355 -0.384 . . . . 74.51 111.781 -176.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.743 HG22 ' H ' ' B' ' 228' ' ' GLN . 2.4 mt -124.12 179.7 2.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.84 -0.43 . . . . 74.13 109.84 -178.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.743 ' H ' HG22 ' B' ' 227' ' ' ILE . 2.3 mp0 -103.82 158.39 16.42 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.822 -0.436 . . . . 52.42 109.822 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . 0.572 HG21 ' CH2' ' A' ' 46' ' ' TRP . 25.4 m -67.08 -16.44 64.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.212 0.53 . . . . 72.42 110.656 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -62.85 -33.36 86.78 Favored Glycine 0 CA--C 1.521 0.449 0 CA-C-N 115.603 -0.726 . . . . 70.23 113.733 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -72.45 -26.89 62.0 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 117.573 0.687 . . . . 71.35 110.6 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.7 t -72.06 -46.76 57.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.138 -0.483 . . . . 75.2 110.129 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 3.2 p -62.49 -34.52 77.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 61.32 110.366 176.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -69.81 -35.9 75.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.912 -0.585 . . . . 72.53 111.255 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 59.8 m -67.04 -35.38 79.74 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.09 0.471 . . . . 44.4 109.889 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' A' ' 14' ' ' LEU . 8.5 t80 -67.47 -38.71 84.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.734 -0.666 . . . . 64.34 109.69 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.829 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.6 ttm -65.97 -48.22 71.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.539 -0.755 . . . . 72.14 111.42 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.471 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 17.3 t-105 -61.15 -40.53 94.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 71.53 110.463 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.558 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.76 -42.16 99.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.882 -0.599 . . . . 55.43 110.997 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.725 HD21 ' SD ' ' A' ' 37' ' ' MET . 49.6 tp -60.75 -40.52 92.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 71.51 110.741 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.4 95.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.099 -0.501 . . . . 64.01 110.671 178.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . 0.478 ' HG3' ' OD1' ' A' ' 80' ' ' ASN . 64.3 ttt180 -67.08 -32.57 73.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.572 -0.74 . . . . 74.42 110.608 -179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.726 ' HD1' HG23 ' A' ' 15' ' ' ILE . 23.0 t80 -77.52 -40.06 44.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 65.34 110.992 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -73.2 -24.49 60.53 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.772 0.286 . . . . 74.42 111.772 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.493 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -68.55 -19.77 64.51 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.247 0.546 . . . . 74.4 110.958 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.1 t90 -59.88 -33.46 71.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.241 -0.89 . . . . 64.2 111.054 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -72.84 -6.52 45.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.854 -0.612 . . . . 61.3 112.502 -171.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -59.8 -30.99 70.47 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.011 -1.09 . . . . 64.14 110.916 172.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . 0.515 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 6.6 m -66.36 -16.29 63.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.724 0.41 . . . . 74.14 111.741 -177.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -116.43 17.33 15.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.067 0.46 . . . . 35.34 110.808 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 39.8 t -81.34 -56.55 3.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.031 -0.531 . . . . 71.23 110.655 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 5.2 m-85 -137.69 178.76 6.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.083 0.468 . . . . 74.34 112.188 -177.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 8.9 pt-20 -94.76 -33.75 12.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.36 -0.836 . . . . 75.21 110.985 -173.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.425 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 75.4 p -114.21 154.34 28.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.242 -0.435 . . . . 72.35 110.211 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.505 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 21.3 ptmt -70.03 -29.8 66.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.816 0.341 . . . . 74.44 110.292 -178.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . 0.425 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.9 mp0 -55.17 -48.43 73.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.685 -0.689 . . . . 44.22 110.415 177.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.702 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.4 mt-30 -80.54 -41.82 23.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.73 -0.668 . . . . 75.42 109.986 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.515 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.1 ttt -55.18 -44.51 75.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.602 -0.726 . . . . 74.11 111.483 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.569 ' HA ' HD13 ' A' ' 85' ' ' ILE . 36.0 tt0 -64.75 -40.98 96.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.515 . . . . 73.14 111.432 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.74 -5.96 33.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 53.41 111.685 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.702 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 27.6 mmmt -106.75 4.73 27.98 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.247 -0.279 . . . . 72.45 110.247 -177.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.474 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.6 ptpt -51.38 -46.0 62.66 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.431 0.457 . . . . 71.02 110.788 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.474 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 11.3 tp60 -84.27 -18.03 37.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.766 0.317 . . . . 75.33 110.521 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -85.24 -30.56 23.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.525 . . . . 70.54 111.26 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -81.75 -29.0 33.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.342 -0.984 . . . . 51.33 108.342 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.557 ' CE ' ' HB3' ' A' ' 77' ' ' LEU . 71.9 mtp -87.87 11.23 16.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.864 -1.062 . . . . 53.32 110.462 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -75.0 -38.03 61.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 74.22 111.027 -177.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.595 ' HA ' ' OD2' ' B' ' 271' ' ' ASP . 42.7 p90 -114.07 -4.21 13.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.884 -0.598 . . . . 61.42 110.818 -175.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.434 ' O ' ' HE1' ' A' ' 37' ' ' MET . 3.6 m-30 -56.68 -52.46 64.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 121.02 -0.272 . . . . 73.42 110.607 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 1.038 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.55 -50.85 52.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.619 0.574 . . . . 71.33 110.888 177.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . 0.595 ' OD2' ' HA ' ' B' ' 268' ' ' TYR . 2.9 p30 -85.47 22.07 1.63 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.643 . . . . 74.13 112.647 -171.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 33.3 mtp180 -82.03 -34.98 29.29 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.539 -0.464 . . . . 71.43 110.259 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 1.013 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.7 12.93 34.14 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.445 -0.502 . . . . 54.23 109.75 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.467 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 86.5 tttt -58.49 -54.87 42.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.726 -0.67 . . . . 55.31 110.261 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.38 -31.76 72.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.573 -0.739 . . . . 74.35 111.281 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 58.2 mtt -71.49 -36.28 71.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.927 -0.579 . . . . 61.13 110.389 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.683 HD21 ' HD2' ' A' ' 69' ' ' TYR . 38.0 tp -70.35 -41.21 73.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.292 -0.867 . . . . 71.22 110.127 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -60.9 -45.26 95.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.782 -0.644 . . . . 75.43 110.408 178.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -66.26 -17.08 64.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.239 -0.891 . . . . 63.24 112.235 -176.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . 0.402 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 36.4 m-80 -102.13 -2.08 30.14 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.879 -0.328 . . . . 73.3 111.392 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.474 ' HG2' ' HB1' ' A' ' 45' ' ' ALA . 46.2 mtt -91.54 -177.25 4.75 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.862 -0.335 . . . . 73.32 110.428 174.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.732 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 46.1 mt-10 67.38 -3.36 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.67 -0.696 . . . . 72.24 112.598 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.29 -58.75 5.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.07 0.462 . . . . 74.44 110.398 176.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -84.96 -3.13 58.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.778 -0.646 . . . . 72.42 110.996 177.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.732 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 63.1 mt -85.01 -59.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.724 0.297 . . . . 73.12 110.437 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -67.11 -18.44 65.31 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.968 0.413 . . . . 70.11 110.561 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -107.01 6.92 29.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 75.43 111.011 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 60.7 t80 -59.19 -48.89 79.93 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.852 -0.425 . . . . 74.4 109.852 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 C--N 1.325 -0.49 0 CA-C-N 115.566 -0.743 . . . . 45.31 110.443 178.132 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.4 p-10 . . . . . 0 N--CA 1.451 -0.423 0 N-CA-C 108.422 -0.955 . . . . 51.24 108.422 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -84.14 -66.06 0.94 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.732 0.301 . . . . 71.21 111.416 -174.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -124.22 -41.44 2.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.457 -0.571 . . . . 74.24 109.457 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.76 157.25 31.79 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.551 -0.75 . . . . 74.54 110.635 177.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.502 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.31 43.41 0.72 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.092 -0.958 . . . . 64.1 112.468 -175.122 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -52.48 -51.42 59.44 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.885 0.374 . . . . 73.44 111.589 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.412 ' H ' ' HB3' ' A' ' 3' ' ' ASN . . . -69.35 -5.57 24.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 53.34 111.759 -177.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.502 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 27.6 mmt180 -100.72 -58.88 1.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.313 -0.254 . . . . 75.53 110.313 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.739 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -52.19 -25.54 9.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.462 0.542 . . . . 62.52 112.462 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -62.89 -24.77 67.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.61 -0.268 . . . . 74.52 111.062 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.571 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.0 mt-10 -86.24 -28.96 23.5 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-O 121.108 0.48 . . . . 73.51 110.024 -178.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.739 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -64.26 -47.15 80.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.587 -0.733 . . . . 70.22 109.613 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.427 HG13 ' HB1' ' B' ' 239' ' ' ALA . 62.0 mt -69.51 -28.45 37.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.931 -0.577 . . . . 64.53 110.275 176.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 13' ' ' GLU . 2.7 mmmt -63.91 -28.69 70.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.543 . . . . 72.3 111.296 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.617 HD12 HD13 ' B' ' 214' ' ' LEU . 2.7 tm? -78.27 -31.13 48.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.259 -0.645 . . . . 62.21 109.259 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.75 -44.06 74.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.719 -0.673 . . . . 71.32 109.404 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.515 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 6.5 m-20 -58.21 -27.66 64.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.27 -0.877 . . . . 73.11 110.643 175.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -75.27 -32.39 61.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 75.24 110.813 -176.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -86.24 -20.4 28.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.426 0.632 . . . . 74.24 109.75 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.09 -10.05 59.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.142 -0.935 . . . . 73.41 109.574 176.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 80.3 mt-30 -77.48 -10.29 59.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.557 -0.747 . . . . 73.44 110.799 177.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.596 HD22 HG13 ' A' ' 27' ' ' ILE . 2.1 t30 -71.26 103.9 2.97 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.076 -0.713 . . . . 75.23 109.076 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -46.8 -44.73 19.45 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.528 0.936 . . . . 72.12 113.528 -173.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.57 -4.02 54.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.321 0.489 . . . . 74.54 112.321 -173.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.596 HG13 HD22 ' A' ' 24' ' ' ASN . 7.6 mt -104.0 151.4 6.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.649 -0.5 . . . . 71.14 109.649 177.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -98.97 160.15 14.46 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.177 -0.465 . . . . 74.05 110.382 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.08 -33.4 65.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.935 -0.575 . . . . 70.22 110.744 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.74 -33.65 83.55 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.484 -0.78 . . . . 54.1 113.828 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -74.63 -26.25 59.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.734 0.767 . . . . 73.44 110.365 -174.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -76.16 -32.84 23.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.671 -0.695 . . . . 75.04 110.305 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.577 ' O ' ' HG3' ' A' ' 37' ' ' MET . 92.1 p -72.4 -12.59 61.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.293 -0.412 . . . . 70.3 110.258 177.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -90.86 -39.72 12.16 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.121 -0.491 . . . . 73.23 110.798 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.45 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 5.6 p -67.41 -31.01 70.93 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.162 0.506 . . . . 74.34 110.276 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.644 ' HB3' HD13 ' B' ' 240' ' ' LEU . 2.6 t80 -68.52 -29.38 67.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 71.35 110.378 178.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.658 ' HG2' HD21 ' B' ' 240' ' ' LEU . 51.0 mtp -77.52 -45.69 24.71 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.719 -0.219 . . . . 75.34 110.635 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.0 t-105 -60.67 -38.92 86.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 74.44 110.138 176.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.454 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.49 -47.89 77.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.584 -0.735 . . . . 63.12 110.926 177.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.595 HD21 ' HG2' ' B' ' 237' ' ' MET . 51.2 tp -63.25 -40.5 97.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.714 0.292 . . . . 50.44 110.514 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.507 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -54.69 -46.68 74.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.765 -0.652 . . . . 51.12 111.496 -178.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -13.13 51.35 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.211 -0.595 . . . . 74.44 110.97 -177.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -80.94 -35.08 32.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.028 -0.73 . . . . 73.01 109.028 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -67.73 -35.13 78.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.888 -0.596 . . . . 65.1 109.535 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.579 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -71.83 -17.81 62.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.656 -0.702 . . . . 72.11 111.529 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.2 t90 -63.4 -22.54 66.94 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.17 0.51 . . . . 75.11 110.224 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -89.32 -4.07 58.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 71.04 111.373 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.99 -37.69 60.27 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.603 -0.808 . . . . 32.23 112.124 -179.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.474 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 33.5 p -67.48 -23.18 65.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.895 0.379 . . . . 74.11 111.441 -176.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.9 t -100.19 11.28 39.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.15 0.5 . . . . 73.22 110.278 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 t -85.88 -29.53 23.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.422 -0.354 . . . . 54.3 110.685 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.834 ' HE2' ' HE3' ' A' ' 61' ' ' LYS . 0.3 OUTLIER -145.46 -175.21 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.208 0.447 . . . . 72.41 112.208 -179.721 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.54 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.7 pt-20 -99.1 -32.28 11.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.418 -0.81 . . . . 72.43 112.162 -172.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.54 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.6 p -128.59 156.79 42.8 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 116.241 -0.436 . . . . 65.04 109.911 -178.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.624 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.6 ptmm? -69.05 -27.52 65.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.842 0.353 . . . . 72.24 110.641 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -63.45 -49.15 74.79 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.875 -0.602 . . . . 74.31 110.294 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.639 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -79.71 -36.97 36.69 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.813 -0.63 . . . . 62.31 110.31 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.484 ' HE1' HG12 ' B' ' 285' ' ' ILE . 14.3 ttt -60.2 -40.42 90.03 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.04 -0.527 . . . . 62.54 111.219 178.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.666 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.3 tt0 -63.7 -30.86 71.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.027 -0.533 . . . . 73.14 111.231 -177.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.67 -9.23 59.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.04 0.448 . . . . 50.04 111.042 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.834 ' HE3' ' HE2' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -105.0 -5.46 20.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.213 -0.449 . . . . 71.51 110.338 -176.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HD2' ' N ' ' A' ' 63' ' ' GLN . 0.6 OUTLIER -51.86 -54.91 23.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 61.13 110.866 -177.603 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.506 ' N ' ' HD2' ' A' ' 62' ' ' LYS . 11.0 tp60 -75.31 -13.13 60.4 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.098 -0.501 . . . . 75.41 110.687 -175.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -87.55 -32.87 19.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.477 -0.328 . . . . 73.33 111.032 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.7 ptp -81.79 -26.73 34.17 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.497 -0.927 . . . . 52.13 108.497 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.557 ' HE3' ' HB3' ' B' ' 277' ' ' LEU . 71.6 mtp -83.3 -9.85 58.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.054 -0.975 . . . . 64.22 110.508 175.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 30.1 t70 -66.53 -18.13 65.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.996 -0.547 . . . . 73.12 111.153 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.501 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 26.6 p90 -124.63 -0.69 8.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.048 -0.524 . . . . 73.41 110.637 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.586 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 1.5 m-30 -66.79 -56.85 8.61 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 121.352 -0.139 . . . . 54.23 111.045 -178.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.877 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -46.55 -54.26 9.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.122 0.487 . . . . 74.23 110.363 174.812 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -81.6 17.42 1.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.803 -0.635 . . . . 63.51 111.771 -174.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.586 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -85.09 -50.2 7.63 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.028 0.442 . . . . 71.21 110.416 -177.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.602 ' HB3' ' HB3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -89.86 10.55 23.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.428 0.633 . . . . 64.14 109.646 -174.697 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 82.2 tttt -60.96 -49.73 76.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.069 -0.969 . . . . 65.21 110.735 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -58.95 -41.98 88.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 70.55 110.906 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 54.0 mtt -64.28 -36.45 84.13 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.653 -0.703 . . . . 73.11 110.354 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 2.3 tt -74.55 -44.88 48.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.326 -0.852 . . . . 73.42 110.353 -176.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -60.64 -38.74 85.8 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.327 0.584 . . . . 72.14 110.313 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.16 -24.64 66.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.196 -0.911 . . . . 74.24 111.668 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -99.4 -20.68 16.35 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.74 -0.384 . . . . 72.22 110.429 -178.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.746 ' HE2' ' HA ' ' B' ' 245' ' ' ALA . 16.5 mmt -61.67 -63.85 1.13 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.079 -0.51 . . . . 75.2 110.503 174.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.606 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 35.7 mt-10 -71.53 -7.34 47.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.074 -0.512 . . . . 75.24 111.479 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.89 -46.24 75.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.711 -0.477 . . . . 72.02 109.711 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -73.3 -35.64 66.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.05 -0.523 . . . . 73.12 110.268 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.606 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 86.5 mt -61.49 -54.27 37.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.853 -0.612 . . . . 54.42 111.655 -178.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.2 pt-20 -63.9 -19.56 65.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.822 0.344 . . . . 64.32 111.355 -177.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -104.95 6.87 33.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.466 -0.333 . . . . 74.24 111.093 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 84.3 t80 -60.97 -38.75 87.06 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.468 -0.567 . . . . 64.55 109.468 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--N 1.327 -0.385 0 CA-C-N 115.325 -0.852 . . . . 52.52 109.347 175.584 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.716 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 109.624 -0.51 . . . . 74.51 109.624 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . 0.938 ' HG2' ' HE2' ' B' ' 208' ' ' TYR . 1.6 pm0 -60.52 -88.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.139 0.422 . . . . 72.43 112.139 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -112.26 -40.37 4.18 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.437 -0.505 . . . . 75.32 110.957 -178.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -81.69 156.66 24.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.176 -0.465 . . . . 70.32 111.147 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.45 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -76.92 53.4 0.93 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.228 -0.896 . . . . 74.23 112.259 -178.949 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.938 ' HE2' ' HG2' ' B' ' 204' ' ' GLU . 63.3 m-85 -55.45 -44.25 76.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.71 0.291 . . . . 73.04 111.314 -178.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.54 -20.46 64.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.073 -0.512 . . . . 34.13 111.925 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -91.44 -62.58 1.4 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.104 -0.239 . . . . 71.24 110.686 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.746 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -53.74 -24.06 13.77 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.802 0.667 . . . . 51.33 112.802 -176.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 11.8 t -65.0 -28.09 69.27 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.672 0.272 . . . . 64.11 111.161 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.526 ' HB2' HD11 ' A' ' 17' ' ' LEU . 48.3 mt-10 -82.32 -25.23 34.1 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.331 0.586 . . . . 71.34 109.897 -176.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.746 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.3 mm? -67.04 -44.65 79.69 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.282 -0.872 . . . . 72.03 108.985 178.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.454 HG13 ' HB1' ' A' ' 39' ' ' ALA . 78.1 mt -73.07 -30.45 31.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.494 -0.775 . . . . 61.24 110.407 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.433 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 39.4 tptt -53.58 -45.53 70.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.765 -0.652 . . . . 75.41 111.344 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.2 tm? -64.31 -40.01 95.06 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.757 -0.461 . . . . 75.34 109.757 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -62.13 -27.01 68.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 75.44 110.973 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 94.7 m-20 -66.58 -31.68 72.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 53.44 110.65 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -74.09 -32.24 63.15 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.746 0.308 . . . . 71.44 111.338 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -82.18 -15.82 51.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.148 0.499 . . . . 72.14 110.546 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -78.73 -16.08 57.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.839 -0.619 . . . . 65.11 109.712 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 59.6 mm-40 -85.5 -10.55 55.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.643 -0.708 . . . . 73.11 109.813 177.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.789 HD22 ' HG2' ' B' ' 226' ' ' GLU . 1.8 t30 -71.55 114.53 9.73 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.147 -0.933 . . . . 70.21 110.141 -175.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -58.96 -31.61 68.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.47 -0.786 . . . . 72.41 112.998 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . 0.789 ' HG2' HD22 ' B' ' 224' ' ' ASN . 12.0 pt-20 -82.69 -7.64 59.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.738 0.304 . . . . 70.43 111.383 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.582 ' CG2' ' HB2' ' B' ' 231' ' ' GLU . 4.5 mt -113.15 149.12 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.01 110.419 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -102.68 164.2 11.78 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.534 -0.543 . . . . 65.12 109.534 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 2.3 m -54.62 -38.51 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.965 0.412 . . . . 54.21 111.387 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -77.63 -8.74 87.16 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.121 -0.562 . . . . 64.1 113.663 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.582 ' HB2' ' CG2' ' B' ' 227' ' ' ILE . 5.8 mm-40 -88.72 -33.32 17.56 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.564 0.682 . . . . 72.01 109.539 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.2 t -71.81 -38.81 66.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.4 110.272 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 21.4 p -63.5 -43.05 98.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 61.34 110.4 178.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -70.99 -26.6 63.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.582 . . . . 41.53 110.866 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.429 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.5 t -66.55 -33.69 76.24 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.562 0.696 . . . . 75.14 109.158 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.609 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 5.7 t80 -73.38 -28.55 62.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.111 -0.949 . . . . 74.14 109.842 177.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.602 ' HB3' ' HB3' ' A' ' 73' ' ' TYR . 51.7 mtp -75.64 -46.19 32.96 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.368 -0.378 . . . . 70.35 110.611 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.409 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 27.2 t-105 -60.85 -40.35 92.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.089 0.471 . . . . 63.24 110.166 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.427 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.54 -45.56 92.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.609 -0.723 . . . . 54.55 110.81 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.658 HD21 ' HG2' ' A' ' 37' ' ' MET . 52.1 tp -67.82 -38.41 83.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.895 0.379 . . . . 64.21 110.511 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.565 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -56.87 -49.58 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.794 -0.639 . . . . 63.31 111.472 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -86.78 6.37 31.85 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.072 -0.651 . . . . 72.32 110.887 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -99.63 -36.66 9.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.838 -0.801 . . . . 71.13 108.838 172.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.35 -39.02 85.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.822 -0.626 . . . . 53.22 109.575 173.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.746 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -67.21 -16.55 64.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.614 -0.721 . . . . 72.41 111.732 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -58.86 -34.97 72.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 72.34 110.858 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -76.53 -2.94 34.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 71.23 111.777 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -67.27 -30.08 75.07 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.55 -0.833 . . . . 61.2 111.26 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.0 p -63.89 -22.18 66.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.954 0.407 . . . . 73.14 111.262 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.9 t -111.91 18.27 18.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.325 -0.398 . . . . 73.52 110.73 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 9.7 t -81.32 -39.79 24.61 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.771 -0.455 . . . . 71.5 109.771 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.863 ' HE2' ' HE3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -149.17 -174.63 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 74.01 111.213 179.153 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.472 ' HG3' ' N ' ' B' ' 254' ' ' THR . 12.9 pt-20 -90.34 -50.84 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.774 -0.648 . . . . 65.24 112.061 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.472 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 80.6 p -107.56 164.06 12.54 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 110.444 -0.206 . . . . 74.13 110.444 -176.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.556 ' HB2' HG23 ' A' ' 85' ' ' ILE . 22.6 ptmt -65.61 -33.48 76.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.766 0.317 . . . . 60.43 110.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.18 -45.8 83.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.99 -0.55 . . . . 73.23 111.072 -177.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -87.66 -7.11 57.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.134 -0.485 . . . . 64.53 111.21 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 9.9 ttt -93.29 -41.5 9.83 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.318 0.58 . . . . 75.21 109.959 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.536 ' HA ' HD13 ' A' ' 85' ' ' ILE . 44.4 tt0 -56.27 -42.48 77.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.199 -0.909 . . . . 74.44 111.171 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.29 -5.73 24.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.459 -0.791 . . . . 51.03 111.83 -176.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.863 ' HE3' ' HE2' ' B' ' 252' ' ' PHE . 0.1 OUTLIER -109.93 5.24 22.24 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.434 -0.348 . . . . 62.54 110.65 -175.696 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.594 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 13.5 ptpt -51.04 -47.59 61.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 64.21 111.399 -178.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.594 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 12.4 tp60 -78.89 -11.97 60.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.566 -0.288 . . . . 73.23 111.05 -173.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.89 -43.23 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.669 -0.241 . . . . 71.11 111.294 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' B' ' 265' ' ' MET . 2.7 ptt? -76.81 -30.03 56.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.77 -0.772 . . . . 75.21 109.382 176.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.54 ' HG2' HD22 ' A' ' 77' ' ' LEU . 62.4 mtp -88.39 16.39 6.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.805 -0.634 . . . . 72.1 110.41 177.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 20.7 t70 -90.01 -36.49 14.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.136 0.493 . . . . 64.33 109.696 175.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.409 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 39.8 p90 -107.72 -14.53 14.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.983 -0.553 . . . . 72.33 111.544 -174.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -57.17 -60.72 3.18 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 121.018 -0.273 . . . . 73.22 110.533 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.877 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.07 -45.39 52.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.645 0.736 . . . . 62.02 110.181 175.935 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -84.26 9.01 14.04 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.088 -0.96 . . . . 74.04 112.052 -170.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 2.9 mtm180 -88.39 -41.4 12.84 Favored 'General case' 0 CA--C 1.513 -0.453 0 O-C-N 121.834 -0.541 . . . . 73.21 110.648 -176.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.581 ' HB3' ' HB3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -94.79 7.48 45.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.509 0.671 . . . . 73.31 109.268 -175.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 79.5 tttt -61.54 -57.16 13.2 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.688 -1.142 . . . . 73.33 111.14 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.4 -32.6 74.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.703 0.287 . . . . 74.33 110.882 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 63.8 mtt -60.93 -41.12 95.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.481 0.658 . . . . 53.33 109.509 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.557 ' HB3' ' HE3' ' A' ' 66' ' ' MET . 0.9 OUTLIER -69.49 -41.87 75.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.147 -0.933 . . . . 65.02 109.73 179.08 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.76 -41.45 86.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.543 -0.753 . . . . 72.2 110.611 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.9 -20.87 59.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.255 -0.884 . . . . 75.32 112.034 -177.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -92.25 -24.68 18.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.676 -0.41 . . . . 72.12 110.556 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.579 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 18.3 mmt -58.98 -59.3 5.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.916 -0.584 . . . . 72.22 110.69 174.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.591 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.9 mt-10 -63.57 -20.99 66.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.595 -0.73 . . . . 72.43 112.336 -174.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.92 -48.72 77.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.176 0.512 . . . . 71.3 110.139 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -77.07 -25.32 52.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.005 -0.543 . . . . 74.11 110.445 178.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.666 HD13 ' HA ' ' A' ' 59' ' ' GLN . 63.4 mt -71.03 -56.31 11.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.095 -0.502 . . . . 62.01 111.279 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -64.4 -28.21 69.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.739 0.304 . . . . 74.53 111.64 -176.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -91.71 3.21 55.63 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.99 -0.284 . . . . 72.25 111.087 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.624 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 80.4 t80 -59.14 -39.78 83.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.85 -0.159 . . . . 74.35 110.935 -179.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 . . . . . 0 C--N 1.326 -0.42 0 CA-C-O 121.079 0.466 . . . . 71.01 110.212 178.26 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.5 p-10 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.844 0.354 . . . . 74.21 110.178 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.432 ' HB3' ' H ' ' A' ' 5' ' ' ASN . 9.4 tp10 -79.5 -86.37 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.416 -0.587 . . . . 75.35 109.416 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.432 ' H ' ' HB3' ' A' ' 4' ' ' GLU . 23.6 t30 -113.09 -42.71 3.49 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.765 -0.828 . . . . 71.42 108.765 170.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -71.81 154.12 41.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.271 -0.877 . . . . 71.11 111.972 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.487 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -77.77 57.07 1.6 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.239 -1.346 . . . . 74.31 111.954 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.436 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 67.3 m-85 -54.75 -40.91 69.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.315 -0.402 . . . . 63.44 111.802 -178.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.74 -16.18 61.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 65.02 111.655 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -87.33 -60.91 1.84 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.532 -0.304 . . . . 73.11 110.389 176.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.795 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -61.53 -16.74 50.5 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.887 0.699 . . . . 53.13 112.887 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.552 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 14.7 t -65.05 -30.44 71.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.035 -0.266 . . . . 53.32 111.016 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.541 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.2 mt-10 -81.6 -26.36 34.96 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.167 0.508 . . . . 74.43 110.151 -176.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.795 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.6 mm? -63.6 -41.67 98.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.543 -0.753 . . . . 73.43 109.804 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.497 HG23 ' HD2' ' B' ' 243' ' ' TYR . 69.1 mt -72.71 -22.74 20.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.609 -0.723 . . . . 70.02 110.688 178.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 12' ' ' THR . 30.7 mmmt -64.42 -34.57 78.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.564 -0.289 . . . . 74.11 111.024 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -63.13 -37.27 86.55 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.009 -0.737 . . . . 75.51 109.009 177.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.47 71.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.657 -0.701 . . . . 74.05 110.491 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.52 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 12.1 m-80 -59.96 -43.53 95.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.762 -0.654 . . . . 63.51 110.553 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -65.46 -35.23 80.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.769 -0.651 . . . . 73.24 111.436 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.37 -27.21 41.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 72.41 110.633 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.88 -0.91 36.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.316 0.579 . . . . 73.41 110.288 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 94.4 mt-30 -75.16 -8.85 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.034 -0.53 . . . . 72.32 109.982 174.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.608 HD22 ' HG2' ' A' ' 26' ' ' GLU . 1.4 m120 -78.93 156.14 28.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.323 -0.853 . . . . 75.54 110.1 175.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.2 t -128.46 -14.78 4.66 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.131 0.491 . . . . 61.12 109.922 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.608 ' HG2' HD22 ' A' ' 24' ' ' ASN . 1.6 pm0 -83.94 -2.73 57.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.563 -0.744 . . . . 64.32 110.303 174.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.2 mt -122.86 149.28 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 108.829 -0.804 . . . . 55.13 108.829 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.722 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -77.8 150.68 34.25 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.813 0.339 . . . . 64.53 110.391 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -61.3 -31.4 71.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.288 0.566 . . . . 72.11 109.771 174.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.712 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -68.08 -22.14 74.07 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.495 -0.775 . . . . 65.12 113.296 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.722 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 11.3 mm-40 -74.24 -34.25 63.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.334 0.588 . . . . 73.42 109.69 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.5 t -69.43 -44.61 79.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.592 -0.731 . . . . 73.12 110.534 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.421 ' HB3' ' CE1' ' B' ' 243' ' ' TYR . 15.1 p -65.29 -39.43 92.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.096 -0.502 . . . . 71.34 110.709 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.95 -35.01 79.79 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.847 -0.615 . . . . 64.33 110.383 177.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.538 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 52.5 m -63.83 -40.26 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.847 0.356 . . . . 73.41 110.096 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.703 ' HD1' HD12 ' B' ' 214' ' ' LEU . 10.4 t80 -62.06 -40.53 96.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.362 0.601 . . . . 64.31 109.737 177.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.676 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.4 ttm -67.14 -45.44 77.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.582 -0.736 . . . . 72.22 111.612 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.604 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 18.8 t-105 -64.61 -35.79 82.16 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.986 0.422 . . . . 72.03 110.568 177.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.447 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.74 -39.39 93.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.134 -0.485 . . . . 61.02 110.657 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 56.4 tp -65.62 -35.6 81.3 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.466 -0.334 . . . . 71.24 110.161 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.3 -44.13 95.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 71.52 110.809 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.23 -35.68 66.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.175 -0.466 . . . . 62.31 110.627 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.406 ' HE1' ' OG ' ' B' ' 233' ' ' SER . 9.9 t80 -73.7 -33.51 64.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 63.42 110.786 -177.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 6.8 t-20 -76.09 -35.71 59.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.083 0.468 . . . . 41.3 110.767 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.73 -15.1 63.3 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.913 -0.585 . . . . 74.45 111.311 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -59.29 -35.82 74.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.714 -0.676 . . . . 74.54 111.428 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.526 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.3 m-85 -71.44 -9.08 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.402 -0.363 . . . . 62.2 111.888 -176.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -29.56 64.31 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.349 -0.929 . . . . 62.25 111.294 175.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.526 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 50.2 p -61.44 -32.77 72.75 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.709 0.29 . . . . 53.53 111.652 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -103.1 16.86 25.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.185 0.517 . . . . 71.2 110.695 -176.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.29 -47.34 24.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.167 -0.469 . . . . 72.15 110.72 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.457 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.9 OUTLIER -142.68 -175.11 4.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.32 0.581 . . . . 71.25 112.297 -176.929 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -99.09 -28.06 13.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.916 -1.038 . . . . 61.12 111.679 -173.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.2 p -127.56 160.01 32.88 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.14 -0.482 . . . . 55.54 110.302 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.592 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 19.5 ptmt -68.92 -38.01 79.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.548 -0.296 . . . . 75.35 111.19 -177.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -30.2 71.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.502 -0.317 . . . . 74.42 111.415 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -92.29 -29.12 16.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.031 0.443 . . . . 63.01 110.557 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.526 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 17.8 ttt -69.73 -43.8 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.724 -0.671 . . . . 73.34 110.778 178.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.625 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.1 tt0 -62.62 -33.47 75.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.699 -0.682 . . . . 71.14 111.639 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.02 -23.75 64.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.095 0.474 . . . . 74.31 111.133 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.3 mmmt -89.32 -0.36 57.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.917 -0.583 . . . . 63.24 110.777 -174.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.588 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 10.0 ptpp? -51.75 -47.16 64.2 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 123.597 0.561 . . . . 73.04 110.491 -175.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.588 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -86.15 -21.92 27.3 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.085 -0.507 . . . . 65.54 110.214 -175.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.4 ' OE2' ' HD2' ' A' ' 61' ' ' LYS . 48.8 mt-10 -73.41 -40.54 64.19 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.601 -0.727 . . . . 63.15 110.837 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.4 ptp -79.26 -27.58 42.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.257 0.551 . . . . 63.33 109.584 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 62' ' ' LYS . 90.2 mtp -78.71 -17.33 56.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.813 -0.63 . . . . 65.4 110.915 177.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -60.63 -31.27 70.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.196 0.522 . . . . 35.43 111.345 -172.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -108.65 -10.43 15.2 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.598 -0.441 . . . . 72.14 111.005 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.531 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 5.4 m-30 -58.7 -53.94 52.74 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.623 0.249 . . . . 75.5 111.088 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.696 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -50.97 -53.63 31.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.254 0.55 . . . . 75.24 110.725 175.825 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.569 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 4.2 t70 -89.5 32.53 0.86 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.394 -0.821 . . . . 74.32 110.817 -172.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.659 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 2.1 mmm180 -94.01 -37.26 11.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.254 -0.43 . . . . 71.24 111.221 -177.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.718 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -100.19 10.77 40.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.479 -0.328 . . . . 71.31 110.464 -178.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.8 tttp -59.28 -59.72 5.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.589 . . . . 73.52 110.578 -176.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -63.35 -29.44 70.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.735 -0.666 . . . . 75.3 111.561 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.538 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 39.9 mtm -79.49 -27.77 41.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.226 0.536 . . . . 64.23 109.935 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.772 HD21 ' HD2' ' B' ' 269' ' ' TYR . 65.1 tp -70.11 -43.77 70.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.48 -0.782 . . . . 71.4 109.676 176.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.02 -34.09 71.49 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.278 -0.874 . . . . 72.01 110.506 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.17 -12.49 60.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.41 -0.814 . . . . 54.25 112.125 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.436 ' OD1' ' HG2' ' B' ' 242' ' ' ARG . 31.4 m-80 -100.92 -20.41 15.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.988 0.423 . . . . 63.15 111.322 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.417 ' C ' ' H ' ' A' ' 83' ' ' ASP . 63.0 mtt -78.84 -168.07 1.32 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.363 -0.38 . . . . 74.54 110.019 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 6.4 mm-40 68.46 -32.31 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 113.741 1.015 . . . . 74.4 113.741 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.417 ' H ' ' C ' ' A' ' 81' ' ' MET . 27.8 t70 -53.25 -58.3 7.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.88 0.326 . . . . 55.12 111.88 -177.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -88.53 -3.52 58.79 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.875 -0.73 . . . . 74.44 111.121 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.573 HG21 ' HB2' ' B' ' 259' ' ' GLN . 48.6 mt -74.78 -56.91 7.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.082 0.468 . . . . 72.32 109.84 173.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 10.0 pt-20 -60.86 -38.71 86.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 62.04 110.672 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -87.93 8.93 23.96 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.293 -0.412 . . . . 61.42 111.651 -177.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.442 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 72.8 t80 -57.72 -42.32 83.58 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.158 -0.312 . . . . 70.23 110.158 178.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 . . . . . 0 CA--C 1.519 -0.231 0 CA-C-O 121.156 0.503 . . . . 72.41 110.019 177.469 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.67 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.1 p-10 . . . . . 0 N--CA 1.454 -0.248 0 N-CA-C 109.653 -0.499 . . . . 75.32 109.653 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -76.11 -83.43 0.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.11 -0.7 . . . . 74.23 109.11 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -119.57 -30.81 4.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.103 -0.702 . . . . 51.44 109.103 170.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.67 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -88.47 157.18 18.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.688 -0.687 . . . . 64.45 111.811 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.538 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -86.15 49.57 1.81 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.627 -1.17 . . . . 74.42 111.954 -175.571 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -45.13 -50.22 11.35 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.438 0.533 . . . . 72.34 112.438 -176.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . 0.517 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -59.88 -44.09 94.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 75.34 112.229 -174.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 32.3 mmt180 -67.28 -49.99 62.1 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.148 0.425 . . . . 64.2 112.148 -175.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.631 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -63.3 -18.71 63.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.691 0.758 . . . . 72.31 110.62 -177.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . 0.517 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 49.3 m -68.64 -28.12 66.61 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.006 -0.997 . . . . 54.31 111.014 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.408 ' HB2' HD11 ' A' ' 17' ' ' LEU . 28.4 mt-10 -80.06 -29.32 39.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.462 0.649 . . . . 74.03 109.509 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.703 HD12 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -63.94 -45.43 89.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.214 -0.903 . . . . 75.43 109.922 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.447 HG13 ' HB1' ' A' ' 39' ' ' ALA . 77.3 mt -66.8 -24.82 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 54.41 110.302 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.416 ' HD2' HE22 ' B' ' 220' ' ' GLN . 0.0 OUTLIER -66.39 -30.57 70.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 74.35 110.661 -176.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.631 HD12 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -70.37 -40.75 73.81 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.783 -0.821 . . . . 70.11 108.783 175.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.58 -29.88 70.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.474 -0.784 . . . . 75.45 110.183 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.519 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 2.7 t-20 -59.9 -38.34 81.99 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.33 -0.85 . . . . 71.24 110.405 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . 0.416 HE22 ' HD2' ' B' ' 216' ' ' LYS . 2.9 mp0 -69.41 -39.71 77.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.763 -0.653 . . . . 63.21 111.282 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -74.0 -25.24 59.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.159 0.504 . . . . 75.54 110.163 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -84.07 -3.64 58.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.837 -0.62 . . . . 63.4 110.751 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 98.5 mt-30 -71.03 -10.73 60.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.436 0.636 . . . . 70.01 109.94 173.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.557 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.7 OUTLIER -83.42 128.55 34.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.05 -0.977 . . . . 72.31 109.723 177.057 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -98.46 -21.82 16.36 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.079 0.466 . . . . 61.23 110.817 -175.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . 0.557 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.6 pm0 -76.9 -17.93 58.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.084 0.469 . . . . 70.21 110.724 176.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 7.3 mt -98.95 153.49 4.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.518 -0.919 . . . . 72.13 108.518 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.579 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 1.3 mp0 -80.57 146.38 31.28 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.454 -0.572 . . . . 73.03 109.454 176.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 27.6 m -58.25 -33.12 69.02 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.221 -0.659 . . . . 63.1 109.221 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . 0.526 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -61.71 -29.71 72.84 Favored Glycine 0 C--N 1.334 0.44 0 CA-C-N 115.084 -0.962 . . . . 24.42 113.149 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.579 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 11.4 mm-40 -66.2 -36.43 83.05 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 117.356 0.578 . . . . 63.33 109.657 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.1 t -77.78 -27.75 15.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.371 -0.831 . . . . 65.22 110.108 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . 0.462 ' HG ' ' HE2' ' A' ' 47' ' ' PHE . 1.8 m -70.83 -40.92 72.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.797 -0.638 . . . . 55.34 109.46 176.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -71.44 -34.34 70.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.264 -0.88 . . . . 71.11 111.223 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.477 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 30.1 p -67.89 -36.41 80.18 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.949 0.404 . . . . 63.13 110.016 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.58 ' CD1' HD12 ' A' ' 14' ' ' LEU . 6.6 t80 -62.45 -42.04 99.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.522 0.677 . . . . 73.43 109.421 174.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.718 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 8.6 ttm -66.09 -45.83 79.82 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.518 -0.764 . . . . 74.14 111.733 179.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.538 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 33.9 t-105 -63.7 -35.45 80.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 72.42 110.716 177.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -66.17 -35.48 80.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.499 -0.319 . . . . 75.34 110.789 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 52.4 tp -68.04 -35.87 78.97 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.285 -0.635 . . . . 75.24 109.285 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.441 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -66.15 -16.84 64.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.788 -0.642 . . . . 74.32 111.185 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . 0.436 ' HG2' ' OD1' ' A' ' 80' ' ' ASN . 36.8 mtm180 -95.47 -47.77 6.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.993 0.425 . . . . 64.32 110.411 176.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.497 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.6 t80 -70.99 -34.57 71.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.827 -0.624 . . . . 70.51 111.221 -173.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -81.33 -20.28 41.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.056 0.455 . . . . 62.34 111.229 -175.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -78.8 -7.46 57.87 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.469 . . . . 74.13 110.746 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -65.45 -27.64 68.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.487 -0.779 . . . . 73.45 110.908 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.712 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 74.2 m-85 -75.09 -0.52 19.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.08 -0.509 . . . . 72.12 112.037 -175.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -63.2 -27.59 70.83 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.096 -1.05 . . . . 72.22 110.694 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 75.7 p -70.16 -8.63 51.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.456 -0.372 . . . . 72.34 111.672 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 10.8 t -120.87 8.29 10.5 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.967 -0.293 . . . . 53.03 110.873 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 68.6 m -78.0 -44.3 27.03 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-O 120.63 0.252 . . . . 65.32 110.641 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.486 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 2.4 m-85 -149.07 177.57 9.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.867 0.365 . . . . 74.22 111.231 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.403 ' HG3' HG23 ' B' ' 254' ' ' THR . 8.9 pt-20 -91.5 -34.83 14.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.588 -0.733 . . . . 70.24 111.897 -172.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.403 HG23 ' HG3' ' B' ' 253' ' ' GLU . 75.4 p -117.98 161.4 19.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.411 -0.359 . . . . 70.44 110.508 -179.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.442 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.5 ptmt -66.55 -35.05 79.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.488 -0.324 . . . . 61.11 110.954 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.09 -50.03 73.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.061 0.458 . . . . 74.05 110.788 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.662 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 22.0 mt-30 -75.51 -23.62 56.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 75.14 110.392 -177.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.3 ttt -77.32 -47.52 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 74.05 110.665 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.573 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.6 tt0 -63.65 -35.07 79.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.693 -0.685 . . . . 63.13 111.689 -176.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.46 -13.31 62.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.844 0.354 . . . . 70.35 110.975 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.662 ' HD3' ' O ' ' B' ' 257' ' ' GLN . 3.2 mptp? -106.51 9.95 31.42 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.956 -0.566 . . . . 72.05 111.134 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.551 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.0 ptpt -50.37 -46.33 55.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 73.42 110.259 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.551 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.2 tp60 -80.54 -29.74 37.15 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.054 -0.521 . . . . 74.3 110.057 -177.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -67.26 -39.09 86.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 71.02 111.413 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -83.72 -24.29 31.27 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.563 -0.532 . . . . 70.05 109.563 -177.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . . . . . . . . . 75.4 mtp -85.03 -22.37 29.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 73.43 111.599 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 17.0 t70 -62.21 -42.64 99.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.992 0.425 . . . . 72.41 111.025 -170.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.624 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 27.3 p90 -90.35 -14.42 33.12 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.907 -0.588 . . . . 72.02 110.647 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.772 ' HD2' HD21 ' A' ' 77' ' ' LEU . 1.3 m-30 -57.54 -47.12 82.89 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.606 0.241 . . . . 75.21 111.052 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.569 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -56.2 -48.13 77.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.195 0.521 . . . . 75.34 110.422 174.689 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -84.4 20.8 1.58 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.491 -0.777 . . . . 65.34 111.65 -171.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 14.6 mmm180 -90.38 -51.09 5.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 71.11 110.813 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.696 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -92.65 8.83 37.43 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.069 -0.514 . . . . 75.02 110.538 -177.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.485 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 87.8 tttt -59.59 -59.48 5.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.919 -0.582 . . . . 73.4 110.916 -177.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.33 -33.98 77.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.23 -0.441 . . . . 63.23 111.187 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . 0.604 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 41.0 mtm -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.108 0.48 . . . . 74.4 110.441 -178.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 5.5 tt -70.96 -43.42 68.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.998 -0.742 . . . . 74.04 108.998 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -56.38 -37.13 69.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.961 -1.018 . . . . 70.34 111.12 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -68.47 -14.98 63.38 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.447 -0.797 . . . . 75.04 112.36 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -96.6 -13.33 22.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.878 0.371 . . . . 64.32 111.487 -178.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 62.9 mtt -85.56 179.58 7.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.777 0.323 . . . . 72.12 111.122 176.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.559 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 20.6 mt-10 69.89 -24.06 0.15 Allowed 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.416 1.086 . . . . 64.02 113.381 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -50.25 -60.18 3.23 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.896 0.379 . . . . 73.43 111.699 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -85.13 5.66 28.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 62.23 111.221 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.625 HG21 ' HB2' ' A' ' 59' ' ' GLN . 50.3 mt -92.82 -54.73 6.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.876 0.37 . . . . 74.32 110.507 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.8 pt-20 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.053 -0.521 . . . . 54.13 110.337 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.38 2.28 52.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 75.01 111.359 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.592 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 71.0 t80 -55.99 -48.19 76.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.634 0.254 . . . . 74.23 110.915 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 116.182 -0.463 . . . . 74.33 110.712 -178.462 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 . . . . . 0 N--CA 1.452 -0.355 0 N-CA-C 108.944 -0.761 . . . . 63.2 108.944 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.98 -79.69 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.123 0.487 . . . . 64.51 110.759 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -125.71 -35.85 2.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.947 -0.569 . . . . 62.24 110.393 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . . . -80.81 159.82 25.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.091 -0.504 . . . . 74.35 111.005 179.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.567 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -82.06 49.17 1.34 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.293 -0.867 . . . . 71.4 111.995 -176.413 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 6' ' ' ALA . 58.1 m-85 -51.93 -42.21 62.63 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.046 0.451 . . . . 74.21 111.235 -178.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.11 -13.64 61.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.742 -0.663 . . . . 74.21 112.509 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.437 ' HD3' HH11 ' A' ' 10' ' ' ARG . 20.5 mtm180 -94.71 -57.23 2.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.542 -0.463 . . . . 72.24 110.262 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.768 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -57.49 -22.47 44.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 55.01 112.54 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -62.75 -26.92 68.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.745 0.307 . . . . 71.44 110.955 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.487 ' HB2' HD11 ' B' ' 217' ' ' LEU . 30.0 mt-10 -83.12 -29.56 28.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.169 0.509 . . . . 73.02 109.772 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.768 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -62.82 -48.58 78.48 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.244 -0.889 . . . . 74.54 109.42 177.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.512 HG23 ' HD2' ' B' ' 243' ' ' TYR . 78.5 mt -64.07 -33.63 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.661 . . . . 73.14 110.281 176.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.414 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.6 tmmt? -60.11 -35.13 74.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.608 -0.724 . . . . 75.5 111.48 -176.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.463 HD12 HD13 ' B' ' 214' ' ' LEU . 2.6 tm? -63.54 -45.97 88.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.392 -0.596 . . . . 51.41 109.392 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.59 68.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.723 -0.671 . . . . 61.22 111.225 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.45 -26.33 68.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 62.11 111.214 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.585 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 2.9 mp0 -81.07 -14.97 57.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.838 0.351 . . . . 75.35 111.057 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -101.44 -35.28 9.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.95 0.405 . . . . 71.23 110.764 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.649 ' HA ' HG21 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -78.0 -8.95 58.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.208 -0.451 . . . . 73.31 110.721 -175.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.585 ' NE2' ' HA ' ' A' ' 20' ' ' GLN . 8.7 pt20 -80.87 9.0 7.0 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.839 -0.344 . . . . 74.21 111.531 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.598 HD22 HG13 ' A' ' 27' ' ' ILE . 1.8 t30 -82.84 103.46 12.34 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.231 -1.026 . . . . 74.51 108.231 173.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -60.16 -31.68 70.33 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 113.146 0.795 . . . . 74.01 113.146 -169.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -80.68 -13.43 59.03 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.227 0.455 . . . . 74.13 112.227 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.598 HG13 HD22 ' A' ' 24' ' ' ASN . 9.2 mt -98.66 147.8 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.448 -0.575 . . . . 50.01 109.448 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -89.42 159.75 17.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.824 0.345 . . . . 73.23 110.301 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.3 m -56.88 -33.33 66.77 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.529 -0.759 . . . . 75.51 111.315 -176.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -58.27 -32.4 67.75 Favored Glycine 0 C--N 1.332 0.34 0 CA-C-N 115.62 -0.718 . . . . 54.31 113.871 -176.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -69.27 -31.79 70.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.27 0.535 . . . . 74.31 110.932 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.649 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.3 t -88.63 -40.82 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.855 -0.611 . . . . 70.45 110.967 -176.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.8 p -61.59 -41.78 97.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.953 0.406 . . . . 72.33 110.635 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.3 73.88 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.014 -0.539 . . . . 74.33 110.958 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.479 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 46.2 m -63.51 -36.21 83.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.886 0.374 . . . . 61.41 110.068 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.556 ' CD1' HD12 ' B' ' 214' ' ' LEU . 2.5 t80 -69.5 -32.78 71.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.374 0.606 . . . . 73.44 109.66 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.786 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.2 tpt -67.36 -52.33 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.45 -0.795 . . . . 71.02 110.945 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.652 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -63.84 -34.89 78.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.937 -0.574 . . . . 75.45 110.906 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.41 -40.64 97.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.122 -0.49 . . . . 75.51 111.095 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 53.9 tp -68.37 -35.29 77.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.734 -0.469 . . . . 64.25 109.734 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.88 77.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.4 111.0 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.448 ' HG2' ' CG ' ' B' ' 280' ' ' ASN . 10.8 mtp180 -77.48 -46.46 22.42 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.019 -0.272 . . . . 74.24 111.139 177.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.588 ' HD2' HG23 ' B' ' 215' ' ' ILE . 7.5 t80 -66.57 -31.86 72.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 62.41 110.884 -175.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -77.33 -38.3 50.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.038 0.447 . . . . 52.51 109.95 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.88 -19.61 65.04 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.792 -0.64 . . . . 63.21 111.171 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.5 t90 -59.39 -33.54 71.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.845 -0.616 . . . . 72.13 110.029 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -82.66 -5.47 58.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 62.14 111.131 178.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.524 ' O ' ' HE3' ' A' ' 58' ' ' MET . . . -70.62 -23.87 77.36 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.896 -0.881 . . . . 73.35 110.896 174.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -61.46 -31.84 71.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.949 0.405 . . . . 52.21 111.26 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -97.91 13.42 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 71.53 111.103 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.1 m -77.02 -34.59 57.38 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 111.854 0.316 . . . . 71.34 111.854 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.725 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -143.33 -172.27 3.66 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.641 -0.424 . . . . 55.52 111.63 -179.551 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.725 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 16.9 pt-20 -108.31 -30.11 8.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.376 -0.829 . . . . 61.23 112.025 -170.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.451 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 47.1 p -127.87 155.28 44.4 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 109.715 -0.476 . . . . 65.32 109.715 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -72.03 -29.57 64.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.84 -0.344 . . . . 74.25 110.77 -177.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' OE1' ' HB ' ' A' ' 54' ' ' THR . 2.0 mp0 -60.92 -46.19 91.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.231 0.538 . . . . 74.14 110.186 177.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 24.6 mt-30 -81.58 -37.57 27.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.667 -0.697 . . . . 74.23 110.581 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.524 ' HE3' ' O ' ' A' ' 48' ' ' GLY . 16.5 ttt -63.17 -42.73 99.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 63.35 111.211 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 34.9 tt0 -64.69 -32.18 73.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.277 -0.419 . . . . 65.41 110.583 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.57 -12.34 60.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.149 0.5 . . . . 62.31 110.854 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -106.53 11.1 31.0 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.208 -0.451 . . . . 64.31 109.979 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.608 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 15.4 ptpt -54.27 -49.37 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 71.54 110.064 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.608 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.4 tp60 -75.15 -26.97 59.55 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.98 -0.555 . . . . 71.43 110.239 -176.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 61' ' ' LYS . 25.0 mm-40 -58.85 -49.47 77.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.99 -0.55 . . . . 74.23 111.011 -178.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.464 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 3.4 ptt? -82.69 -34.86 27.2 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.067 0.46 . . . . 74.51 110.631 -177.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.531 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 67.1 mtp -77.08 -21.98 53.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 51.14 112.097 -174.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 25.6 t70 -58.95 -36.25 74.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 71.24 111.365 -171.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.492 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 28.2 p90 -107.15 -6.11 17.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 71.52 111.534 -176.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.531 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 3.4 m-30 -58.56 -41.95 86.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.709 0.29 . . . . 73.11 110.943 -178.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.517 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -53.28 -52.35 59.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 64.52 110.665 174.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -90.48 65.98 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 71.13 110.958 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 15.3 mmm-85 -130.98 -23.24 2.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.195 -0.457 . . . . 71.14 111.337 177.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.765 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -116.05 7.74 14.35 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.543 -0.463 . . . . 74.52 111.755 -178.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.3 pttm -76.2 -33.92 59.29 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.856 -0.738 . . . . 74.12 110.323 -173.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 1.6 pm0 -67.69 -25.17 65.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.278 0.561 . . . . 74.11 110.604 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.505 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 58.5 mtm -91.16 -18.95 23.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.818 -0.628 . . . . 71.22 109.971 178.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.487 HD13 ' CE ' ' B' ' 270' ' ' MET . 7.0 tt -82.39 -37.39 25.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.73 -0.668 . . . . 55.12 109.729 176.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.402 ' N ' ' HE1' ' B' ' 266' ' ' MET . 12.8 t70 -57.81 -37.56 73.99 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.256 0.551 . . . . 70.04 110.142 177.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.1 70.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.265 -0.879 . . . . 64.11 111.679 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -82.83 -23.09 33.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.016 0.436 . . . . 74.5 110.286 -178.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.484 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.3 mmt -66.54 -50.28 63.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.81 -0.632 . . . . 60.13 110.123 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 44.7 mt-10 -55.77 -31.82 62.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.681 -0.69 . . . . 73.3 111.637 -177.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -53.7 -34.74 59.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.855 0.36 . . . . 74.44 111.04 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.72 -29.14 10.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.286 -0.415 . . . . 74.51 111.255 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 81' ' ' MET . 58.5 mt -66.77 -64.53 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.653 0.242 . . . . 63.33 111.653 -178.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.3 pt-20 -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.451 -0.5 . . . . 75.0 110.745 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.4 ' ND2' ' HG3' ' A' ' 86' ' ' GLU . 52.1 m-80 -93.04 15.72 14.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.139 -0.482 . . . . 71.34 111.004 -177.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.577 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 24.7 t80 -54.46 -49.78 69.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.707 0.289 . . . . 74.01 110.985 178.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 75.31 111.004 179.148 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 . . . . . 0 N--CA 1.453 -0.275 0 CA-C-O 120.665 0.269 . . . . 72.35 110.562 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . 0.444 ' H ' ' HE2' ' B' ' 208' ' ' TYR . 26.0 mt-10 -82.76 -94.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 54.11 111.164 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . 0.402 ' H ' ' HB2' ' B' ' 204' ' ' GLU . 12.7 t30 -103.32 -26.66 12.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.879 -0.6 . . . . 61.41 110.055 -177.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -110.0 153.29 24.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.581 -0.736 . . . . 64.44 110.475 176.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.652 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -79.05 54.89 1.69 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.422 -0.808 . . . . 71.51 112.464 -177.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.444 ' HE2' ' H ' ' B' ' 204' ' ' GLU . 17.6 m-85 -50.95 -40.8 58.4 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.92 0.39 . . . . 75.22 111.379 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.34 -27.53 66.0 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.479 -0.782 . . . . 71.52 112.696 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 53.6 mtm-85 -91.88 -55.38 3.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.548 -0.461 . . . . 72.01 110.651 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.632 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.4 -22.64 44.31 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 34.13 112.814 -177.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 7.0 t -67.04 -25.81 66.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.95 0.405 . . . . 54.44 110.51 -177.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -82.45 -29.22 30.79 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.345 0.593 . . . . 71.33 109.787 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.632 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -64.51 -45.35 87.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.076 -0.965 . . . . 72.5 109.392 177.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.588 HG23 ' HD2' ' A' ' 43' ' ' TYR . 82.0 mt -67.35 -33.03 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.564 -0.744 . . . . 71.11 110.452 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -35.59 73.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.683 -0.69 . . . . 63.43 111.286 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.535 HD12 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -64.57 -45.37 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.414 -0.587 . . . . 75.33 109.414 178.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.88 -31.84 68.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 74.35 111.164 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.504 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -61.08 -38.08 84.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 71.12 110.919 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -67.68 -34.48 76.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.197 -0.456 . . . . 70.3 111.466 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -79.33 -23.07 43.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.445 0.64 . . . . 73.51 110.049 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -75.64 -16.25 60.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.266 -0.879 . . . . 74.21 110.267 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.504 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 35.7 mt-30 -76.63 -4.11 41.29 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 73.22 111.201 -179.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.55 HD22 HG13 ' B' ' 227' ' ' ILE . 1.5 t30 -73.01 107.66 5.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.545 -0.539 . . . . 34.53 109.545 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.0 t -57.71 -35.71 71.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.017 0.747 . . . . 75.21 113.017 -171.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -85.32 1.55 47.93 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.508 0.559 . . . . 73.32 112.508 -177.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.55 HG13 HD22 ' B' ' 224' ' ' ASN . 5.1 mt -113.76 149.85 16.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.03 0.443 . . . . 61.31 110.326 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -92.53 160.22 15.14 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.853 -0.612 . . . . 65.22 109.875 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 6.8 m -63.02 -29.63 70.97 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.19 -0.459 . . . . 75.53 111.227 -176.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -67.38 -12.22 60.71 Favored Glycine 0 C--N 1.331 0.297 0 CA-C-N 115.901 -0.59 . . . . 73.42 113.339 -177.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.401 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 67.9 mm-40 -83.47 -25.79 30.84 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.342 -0.505 . . . . 74.41 110.524 178.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.9 t -85.35 -39.16 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.963 -0.562 . . . . 43.31 110.43 -177.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.2 p -59.06 -41.64 88.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 74.3 110.957 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.83 -32.1 71.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 74.44 111.016 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 49.9 m -65.43 -38.02 88.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.82 0.343 . . . . 43.44 110.279 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.672 ' HD1' HD12 ' A' ' 14' ' ' LEU . 11.9 t80 -66.36 -33.66 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.259 0.552 . . . . 64.22 109.831 178.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.765 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 9.3 ttm -69.18 -46.0 68.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.507 -0.769 . . . . 72.35 111.735 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.567 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 19.8 t-105 -64.59 -38.51 91.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.85 0.357 . . . . 74.01 110.645 177.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.5 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -61.82 -40.29 94.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.051 -0.522 . . . . 44.34 110.667 178.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.786 HD21 ' SD ' ' A' ' 37' ' ' MET . 45.3 tp -67.84 -32.6 73.24 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.257 -0.429 . . . . 71.44 110.831 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.42 -37.35 85.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.01 110.893 178.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -80.77 -30.69 36.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 72.32 110.888 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.512 ' HD2' HG23 ' A' ' 15' ' ' ILE . 6.6 t80 -82.07 -33.07 30.03 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.082 -0.508 . . . . 64.25 110.999 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . 0.454 ' HB3' HD11 ' A' ' 77' ' ' LEU . 9.9 t-20 -78.28 -38.71 41.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.416 -0.356 . . . . 72.42 111.177 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -63.8 -13.38 43.79 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.073 0.463 . . . . 42.25 111.482 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -54.02 -36.37 62.93 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.511 -0.768 . . . . 70.5 110.258 175.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -78.36 -5.55 52.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 74.1 111.958 -177.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -65.67 -29.82 75.97 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.402 -0.904 . . . . 64.41 111.578 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.5 p -65.07 -34.95 79.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.995 0.426 . . . . 61.34 111.298 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.2 t -92.35 7.74 41.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.419 -0.355 . . . . 71.31 111.298 -176.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 71.2 m -74.41 -40.16 62.18 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 116.737 -0.211 . . . . 63.01 111.386 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.55 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -151.41 -179.31 7.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.19 0.519 . . . . 74.01 111.731 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 7.9 pt-20 -94.42 -45.43 7.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.216 -0.902 . . . . 74.24 111.704 -173.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 41.2 p -106.1 157.87 17.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.369 -0.378 . . . . 70.13 110.227 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.577 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 11.2 ptmm? -66.84 -33.28 75.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.88 0.372 . . . . 73.34 110.237 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.11 -50.39 73.42 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.61 -0.723 . . . . 74.23 110.738 -179.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 24.2 mt-30 -78.66 -31.88 46.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.981 -0.554 . . . . 60.02 110.845 -177.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.7 ttt -64.96 -43.77 91.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.133 0.492 . . . . 74.33 110.194 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -63.09 -35.32 79.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.532 -0.758 . . . . 74.31 110.859 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.3 -11.5 60.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.222 -0.445 . . . . 60.15 111.197 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.59 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -113.44 -1.19 14.24 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.499 -0.319 . . . . 73.11 110.51 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.565 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 29.1 ttpp -55.4 -54.79 39.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.486 -0.324 . . . . 64.22 111.206 -176.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -68.41 -26.72 65.68 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.973 -0.291 . . . . 71.14 110.74 -178.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -73.54 -37.88 65.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.524 -0.307 . . . . 72.42 111.285 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.565 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 17.9 ptp -79.85 -30.21 40.26 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.297 -1.001 . . . . 72.14 108.297 177.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.402 ' HE1' ' N ' ' A' ' 78' ' ' ASP . 58.5 mtp -90.5 29.77 1.24 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.981 -1.008 . . . . 74.12 110.638 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -111.03 -32.91 6.64 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.958 -1.126 . . . . 75.14 107.958 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -87.16 -33.72 19.3 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.576 -1.193 . . . . 72.51 112.617 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -52.53 -52.52 54.39 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.987 -0.745 . . . . 74.45 108.987 177.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.517 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -65.45 -60.72 2.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.225 0.536 . . . . 70.41 110.829 174.263 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -88.82 62.96 6.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.811 -0.631 . . . . 72.33 112.04 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -147.76 -29.07 0.33 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 71.31 111.695 171.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.591 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -84.41 0.9 47.71 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.801 -0.814 . . . . 72.3 108.801 174.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -64.32 -53.87 42.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.414 -1.266 . . . . 74.25 110.676 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.25 -30.84 69.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.43 . . . . 73.13 111.818 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . 0.493 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 60.1 mtm -84.87 -26.66 27.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.84 0.352 . . . . 54.4 110.602 -179.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 273' ' ' TYR . 3.7 tt -67.02 -33.92 76.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.016 -0.538 . . . . 73.43 109.784 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . 0.415 ' N ' ' HE1' ' A' ' 66' ' ' MET . 10.6 t70 -61.29 -44.18 97.65 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.837 -0.62 . . . . 64.23 110.831 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.34 65.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.391 -0.822 . . . . 65.23 111.159 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . 0.448 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 86.1 m-20 -88.65 -15.91 33.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.046 -0.525 . . . . 73.44 110.344 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.404 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -75.5 -39.47 58.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 64.42 109.844 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 42.7 mt-10 -51.22 -39.59 56.9 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.374 -0.83 . . . . 73.4 111.934 -176.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -44.7 -47.81 10.66 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.939 0.774 . . . . 74.32 111.855 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -90.41 -29.86 17.75 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.249 -0.432 . . . . 73.24 111.017 -177.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.404 HG13 ' O ' ' B' ' 281' ' ' MET . 72.4 mt -64.37 -55.53 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 73.34 110.992 179.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.656 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -68.75 -17.63 64.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.283 -0.417 . . . . 54.44 111.664 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -107.95 9.46 28.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.921 0.341 . . . . 73.02 111.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -55.68 -45.73 77.73 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.792 0.329 . . . . 73.54 110.572 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 . . . . . 0 C--N 1.327 -0.411 0 CA-C-N 115.848 -0.615 . . . . 71.41 110.978 178.323 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.599 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 1.7 p-10 . . . . . 0 N--CA 1.453 -0.288 0 N-CA-C 109.665 -0.495 . . . . 71.3 109.665 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.91 -89.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 63.54 110.642 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -111.3 -22.34 11.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.833 -0.621 . . . . 72.44 110.183 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.69 160.96 17.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 75.33 111.192 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.456 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -85.41 49.98 1.86 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.236 -0.893 . . . . 63.43 111.769 -177.668 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.599 ' HD2' ' HB2' ' A' ' 3' ' ' ASN . 89.5 m-85 -52.19 -46.3 65.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.037 0.446 . . . . 74.35 111.321 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.53 -6.53 47.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 54.02 112.02 -174.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.558 ' NE ' ' HA ' ' A' ' 10' ' ' ARG . 4.1 mmp_? -96.37 -58.45 2.06 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 121.089 -0.244 . . . . 61.22 110.561 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.724 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -56.42 -20.35 19.29 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.626 0.602 . . . . 63.02 112.626 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.3 t -69.35 -23.34 63.75 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 121.03 -0.268 . . . . 71.44 111.334 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.559 ' HB2' HD11 ' B' ' 217' ' ' LEU . 59.9 mt-10 -80.66 -28.63 36.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.271 -0.641 . . . . 71.03 109.271 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.724 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -64.41 -43.19 95.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.246 -0.888 . . . . 72.21 109.6 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 78.2 mt -69.46 -25.17 28.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.547 -0.751 . . . . 61.33 110.55 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.468 ' HA ' ' HD2' ' A' ' 16' ' ' LYS . 22.2 mmmt -61.75 -38.51 88.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.374 -0.375 . . . . 74.43 111.872 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.499 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.1 tm? -65.4 -34.23 77.81 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.235 -0.654 . . . . 75.52 109.235 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.98 -35.94 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.584 -0.735 . . . . 74.33 110.393 -177.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -69.92 -12.3 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.969 -0.56 . . . . 62.25 111.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.29 -39.65 17.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.792 0.329 . . . . 74.25 110.692 175.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -76.35 -22.48 54.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.293 0.568 . . . . 64.11 110.259 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.417 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 4.3 t-20 -73.23 -11.82 60.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 74.23 110.553 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -82.22 0.83 39.39 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 116.096 -0.502 . . . . 73.42 111.674 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.633 HD22 HG13 ' A' ' 27' ' ' ILE . 2.9 t30 -73.77 115.46 13.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.22 -0.659 . . . . 65.22 109.22 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -50.18 -41.6 49.65 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.794 1.035 . . . . 63.34 113.794 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -97.5 2.44 50.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.111 0.782 . . . . 73.34 113.111 -171.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.633 HG13 HD22 ' A' ' 24' ' ' ASN . 7.7 mt -104.66 157.54 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.568 -0.53 . . . . 73.45 109.568 178.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -96.45 167.61 11.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.555 -0.535 . . . . 74.21 109.555 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.417 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 5.7 m -60.52 -32.12 71.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.016 0.436 . . . . 62.44 109.871 174.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.697 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -59.46 -38.21 93.19 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.258 -0.883 . . . . 63.41 113.714 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -64.91 -36.79 85.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.163 0.506 . . . . 72.13 110.439 -176.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 17.8 t -73.74 -39.14 52.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.866 -0.607 . . . . 70.03 110.199 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m -59.56 -41.85 91.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.236 0.541 . . . . 71.02 110.248 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 37' ' ' MET . . . -69.4 -29.92 67.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.641 -0.709 . . . . 71.53 110.938 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.2 m -65.18 -38.08 89.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.021 0.439 . . . . 72.21 109.911 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.842 ' HB3' HD13 ' B' ' 240' ' ' LEU . 1.6 t80 -67.99 -34.37 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.849 -0.614 . . . . 72.2 109.753 177.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.756 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 0.8 OUTLIER -61.71 -53.49 55.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.364 -0.834 . . . . 72.4 110.762 177.156 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.46 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 24.2 t-105 -64.89 -40.24 94.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 74.23 111.012 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.38 93.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.343 -0.39 . . . . 72.45 111.241 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 48.3 tp -61.98 -38.18 87.6 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.593 -0.276 . . . . 52.14 110.285 178.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -61.82 -46.07 91.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 43.21 110.711 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -66.86 -39.75 87.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.191 -0.459 . . . . 64.51 111.059 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.711 ' HD2' HG23 ' B' ' 215' ' ' ILE . 11.0 t80 -76.94 -33.93 57.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.372 -0.377 . . . . 74.23 110.853 -176.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 9.8 t-20 -73.02 -43.3 62.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.217 -0.447 . . . . 75.14 110.759 -176.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.442 ' HB2' HD12 ' B' ' 277' ' ' LEU . . . -67.67 -18.61 65.0 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.175 -0.466 . . . . 71.53 111.335 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -59.01 -30.62 68.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.978 -0.555 . . . . 75.13 110.496 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -83.91 -10.11 58.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 73.11 111.282 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.77 -24.02 72.64 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.466 -0.873 . . . . 75.1 111.383 176.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.646 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 79.3 p -69.92 -15.15 63.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 63.11 111.355 -178.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.9 t -114.47 13.26 17.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 61.35 110.855 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -72.04 -35.09 69.25 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 116.505 -0.316 . . . . 53.31 111.501 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.651 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.2 m-85 -147.92 178.74 8.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.409 0.623 . . . . 53.22 112.387 -178.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.593 ' HG3' HG23 ' A' ' 54' ' ' THR . 15.1 pt-20 -91.7 -34.58 14.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.766 -1.107 . . . . 72.35 110.798 -171.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.614 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 80.5 p -124.71 159.3 31.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.498 -0.774 . . . . 74.41 109.219 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.657 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 6.6 pttm -78.67 -23.6 45.61 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.424 -0.51 . . . . 71.52 110.557 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.614 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.6 mp0 -61.34 -40.73 95.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.256 0.55 . . . . 63.32 109.808 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.768 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 21.1 mt-30 -83.52 -40.83 18.67 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.514 -0.766 . . . . 64.53 109.684 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.657 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 17.1 ttt -57.21 -44.55 83.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.755 -0.657 . . . . 72.41 111.605 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.611 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.3 tt0 -59.95 -39.34 85.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.343 -0.389 . . . . 72.13 111.052 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.68 -0.09 19.51 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.998 -0.547 . . . . 73.14 111.24 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.768 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.7 mmmt -112.47 -6.62 13.97 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.55 -0.295 . . . . 72.22 111.24 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 34.2 pttt -63.87 -43.34 96.38 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 119.996 -0.682 . . . . 72.02 110.146 -176.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.579 ' O ' ' HB2' ' A' ' 67' ' ' ASP . 21.5 mm-40 -83.16 3.19 31.89 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.033 0.444 . . . . 73.24 111.168 177.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -97.47 -32.83 11.63 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.651 -0.704 . . . . 73.31 110.426 171.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.407 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 16.7 ptp -85.15 -35.26 21.84 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.682 -0.859 . . . . 52.43 108.682 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.575 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 69.0 mtp -80.64 -18.83 46.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.727 -0.669 . . . . 74.35 111.091 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 22.7 t70 -47.74 -45.75 29.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.672 0.608 . . . . 75.34 111.038 -178.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -108.15 -4.92 17.23 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.399 -0.819 . . . . 73.4 111.115 -176.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.628 ' HD2' HD21 ' B' ' 277' ' ' LEU . 1.8 m-30 -59.22 -48.26 82.28 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 121.305 -0.158 . . . . 73.41 111.05 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.567 ' HE1' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.08 -51.58 63.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.166 0.507 . . . . 54.43 110.206 175.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.466 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 1.9 t70 -90.7 22.74 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.65 -0.704 . . . . 74.24 111.291 -171.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.587 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 3.2 mmm180 -84.71 -44.93 12.92 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.209 0.528 . . . . 70.24 110.251 -176.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.737 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -95.44 15.09 20.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.663 -0.699 . . . . 70.34 109.929 -179.107 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HD2' ' OD2' ' A' ' 71' ' ' ASP . 20.0 tttp -56.15 -61.87 2.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.377 -0.829 . . . . 73.11 110.345 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -67.38 -31.12 71.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.669 -0.696 . . . . 72.1 110.977 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.8 mtt -62.04 -38.86 90.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.349 0.595 . . . . 74.14 109.816 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.591 ' CD2' ' HE2' ' A' ' 81' ' ' MET . 1.6 tt -73.55 -42.28 61.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.298 -0.865 . . . . 73.23 109.499 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.464 ' N ' ' HE3' ' B' ' 266' ' ' MET . 4.9 t70 -57.67 -42.04 82.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.447 -0.797 . . . . 72.32 110.831 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.59 -16.05 59.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.416 -0.811 . . . . 61.04 112.233 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -105.06 -16.07 14.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.844 0.354 . . . . 72.12 110.492 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.591 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 14.0 mmt -67.6 -63.02 1.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.906 -0.588 . . . . 64.32 111.55 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.632 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 8.3 pt-20 -80.6 1.85 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.835 0.68 . . . . 72.41 112.835 -170.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.39 -49.67 76.91 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.152 -0.684 . . . . 61.42 109.152 171.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -72.86 -38.26 67.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.482 -0.781 . . . . 70.24 110.189 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.735 HG21 ' HB2' ' B' ' 259' ' ' GLN . 66.7 mt -58.97 -54.25 36.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.523 -0.762 . . . . 73.14 111.941 -176.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.626 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.1 pt-20 -66.48 -12.15 55.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.652 0.263 . . . . 72.52 111.673 -177.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -110.57 11.4 22.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.668 -0.242 . . . . 74.31 111.4 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.474 ' CE2' ' HA ' ' B' ' 254' ' ' THR . 8.5 t80 -52.71 -56.37 16.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.282 . . . . 74.34 110.294 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.913 -0.585 . . . . 74.04 110.911 -179.625 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.8 p-10 . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 120.634 0.255 . . . . 72.34 110.598 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -68.92 -77.69 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.016 0.436 . . . . 75.5 110.162 175.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -128.51 -31.15 2.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 74.23 110.323 176.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -86.68 179.35 6.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.733 -0.667 . . . . 54.3 111.339 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.54 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -79.68 43.93 0.6 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.433 -0.803 . . . . 75.42 112.674 -174.264 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.75 -43.39 85.37 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.667 0.247 . . . . 72.31 111.667 -177.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.96 -14.88 62.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.033 0.444 . . . . 53.12 111.447 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.54 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 1.4 mmp_? -91.0 -62.16 1.51 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.343 -0.39 . . . . 74.23 110.17 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.836 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.37 -25.77 37.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.699 0.629 . . . . 33.05 112.699 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -67.97 -21.16 65.09 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.764 0.316 . . . . 73.5 110.946 -178.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.409 ' HB2' HD11 ' A' ' 17' ' ' LEU . 50.7 mt-10 -84.64 -27.58 27.06 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.619 -0.511 . . . . 74.32 109.619 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.836 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -62.44 -41.32 98.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.514 -0.767 . . . . 73.51 109.43 176.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.711 HG23 ' HD2' ' A' ' 43' ' ' TYR . 87.5 mt -68.8 -22.83 26.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.204 -0.907 . . . . 73.21 111.027 178.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' B' ' 212' ' ' THR . 30.6 mmmt -66.58 -40.42 88.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 73.34 111.603 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.559 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -62.47 -35.98 81.04 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.058 -0.719 . . . . 65.24 109.058 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . 0.425 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -67.84 -37.42 81.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.731 -0.668 . . . . 54.24 110.145 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.412 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 29.2 m-80 -74.37 -6.49 48.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.99 -0.55 . . . . 72.1 111.509 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -93.98 -32.81 13.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.368 . . . . 73.43 110.789 175.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -75.78 -27.09 57.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.508 0.671 . . . . 74.12 109.689 175.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . 0.465 HD21 HG23 ' B' ' 229' ' ' THR . 3.5 t-20 -71.72 -12.76 61.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.985 -1.007 . . . . 74.41 110.481 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 86.9 mm-40 -75.22 -15.04 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.102 -0.499 . . . . 73.43 111.578 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.756 HD22 HG13 ' B' ' 227' ' ' ILE . 7.1 t30 -71.56 122.45 20.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.189 0.519 . . . . 54.25 109.719 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -65.66 -30.28 70.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.241 -0.89 . . . . 63.34 112.162 -174.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.14 -1.33 45.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.443 0.534 . . . . 71.33 112.443 -172.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.756 HG13 HD22 ' B' ' 224' ' ' ASN . 8.9 mt -99.2 148.63 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.358 -0.608 . . . . 53.4 109.358 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.813 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 42.7 mt-30 -78.21 147.38 34.47 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.859 -0.609 . . . . 75.23 109.865 178.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . 0.465 HG23 HD21 ' B' ' 222' ' ' ASN . 3.8 m -59.82 -34.63 73.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.041 0.448 . . . . 72.52 110.662 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.28 87.68 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.861 -0.609 . . . . 75.25 113.816 -176.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.813 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 16.8 mm-40 -80.49 -29.52 37.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.842 0.821 . . . . 54.11 109.674 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . 0.425 HG11 ' O ' ' B' ' 218' ' ' ALA . 27.7 t -77.35 -41.34 29.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.27 -0.877 . . . . 71.11 110.938 -176.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.8 p -62.27 -40.16 95.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 72.11 110.816 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.45 75.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.899 -0.591 . . . . 74.15 110.934 179.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 64.0 m -65.06 -34.24 77.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 63.22 110.715 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.538 ' CD1' HD12 ' A' ' 14' ' ' LEU . 5.3 t80 -65.83 -36.65 84.07 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.309 0.576 . . . . 55.53 109.808 178.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.737 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.6 ttm -69.52 -48.39 60.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.751 -0.658 . . . . 64.03 111.547 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.456 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 34.9 t-105 -63.33 -35.04 79.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.327 . . . . 72.52 110.782 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.487 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.95 -40.49 95.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 75.12 110.894 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.842 HD13 ' HB3' ' A' ' 36' ' ' PHE . 43.8 tp -69.1 -32.13 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.979 0.418 . . . . 74.34 110.399 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.447 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -63.06 -41.4 99.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.901 -0.591 . . . . 63.14 110.829 178.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -75.3 -26.65 58.88 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.15 0.5 . . . . 74.22 110.275 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -81.4 -36.52 29.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.716 -0.674 . . . . 55.02 110.854 -176.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -74.76 -27.82 60.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.659 0.266 . . . . 72.32 111.376 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.54 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -71.98 -16.0 62.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.243 0.544 . . . . 61.5 111.105 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -55.88 -33.68 64.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 73.31 110.256 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.697 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 56.3 m-85 -71.63 -13.59 61.8 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.019 -0.537 . . . . 53.34 112.173 -177.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.0 87.82 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.254 -0.974 . . . . 74.24 111.489 177.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . 0.461 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 6.1 m -59.96 -30.96 69.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.814 0.34 . . . . 75.1 111.732 -177.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.0 t -102.26 16.86 24.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.056 0.455 . . . . 44.41 111.038 -176.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 22.9 t -78.01 -66.05 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.323 -0.399 . . . . 72.03 110.89 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.626 ' CD1' ' HG3' ' B' ' 261' ' ' LYS . 2.4 m-85 -135.15 -169.99 2.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.293 0.568 . . . . 71.31 112.511 -174.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.733 ' HG3' ' H ' ' B' ' 254' ' ' THR . 5.4 pt-20 -95.82 -61.16 1.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.854 -1.066 . . . . 71.15 110.154 -177.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.733 ' H ' ' HG3' ' B' ' 253' ' ' GLU . 74.8 p -89.81 154.41 19.92 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.89 -0.596 . . . . 74.11 110.461 -177.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 10.4 ptmm? -71.5 -26.82 62.84 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.753 -0.379 . . . . 72.51 110.534 -177.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.8 -51.18 70.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.045 -0.525 . . . . 71.34 110.402 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.652 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 20.5 mt-30 -77.47 -40.72 42.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 63.42 110.063 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.461 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 21.5 ttt -57.79 -40.66 80.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.433 -0.803 . . . . 52.32 111.179 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.735 ' HB2' HG21 ' A' ' 85' ' ' ILE . 30.1 tt0 -71.34 -29.44 64.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.443 . . . . 74.21 111.44 -178.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.25 -15.54 59.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.011 0.434 . . . . 73.15 110.872 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.9 mmmt -95.66 -7.59 37.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.281 -0.418 . . . . 71.34 111.414 -174.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.566 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 56.6 pttt -58.14 -47.08 84.43 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.432 -0.349 . . . . 71.32 110.763 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.553 ' O ' ' HB2' ' B' ' 267' ' ' ASP . 10.4 mm-40 -74.67 -16.05 60.78 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.461 -0.496 . . . . 70.41 111.623 -178.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -80.39 -32.59 37.53 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.779 -0.369 . . . . 74.5 110.407 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.566 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 15.3 ptp -89.73 -26.44 20.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.379 -0.6 . . . . 54.41 109.379 178.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.489 ' HG2' HD22 ' A' ' 77' ' ' LEU . 83.8 mtp -85.02 -20.68 30.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.788 -0.642 . . . . 25.35 111.615 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 9.0 t70 -52.35 -47.64 65.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.485 0.66 . . . . 75.2 110.404 -175.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.45 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 8.8 p90 -96.83 0.12 48.78 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.316 -0.856 . . . . 72.51 110.858 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.465 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.2 m-30 -68.39 -50.52 52.4 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.702 -0.851 . . . . 74.05 108.702 171.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.502 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -53.36 -55.94 20.81 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.589 -0.732 . . . . 64.51 109.868 171.347 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -95.65 74.2 3.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.468 0.651 . . . . 64.13 111.385 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 4.6 mtm180 -127.71 -38.41 1.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.862 -0.608 . . . . 71.51 109.819 168.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.756 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.84 11.78 36.16 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.157 -0.474 . . . . 73.02 110.874 -176.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -64.46 -53.14 52.92 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.679 -0.408 . . . . 74.43 110.811 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.55 -35.31 80.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 62.31 110.866 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . 0.46 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 59.8 mtt -62.73 -43.65 98.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.628 0.727 . . . . 62.21 109.927 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.628 HD21 ' HD2' ' A' ' 69' ' ' TYR . 28.3 tp -70.25 -41.45 73.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.779 -1.101 . . . . 74.3 110.514 -178.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.14 -46.49 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.544 0.687 . . . . 52.41 110.102 178.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.08 -24.02 63.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.838 -1.073 . . . . 63.11 111.669 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.41 -32.15 22.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.998 -0.281 . . . . 71.14 110.654 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.571 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -60.55 -62.92 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.051 -0.522 . . . . 74.01 110.598 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.608 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 10.6 pt-20 -74.29 -7.27 52.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.857 -0.611 . . . . 74.33 112.154 -172.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -58.63 -48.04 82.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.149 0.5 . . . . 71.32 110.051 174.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -87.5 -15.63 37.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.308 -0.405 . . . . 73.55 111.197 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.611 HD13 ' HA ' ' A' ' 59' ' ' GLN . 57.5 mt -70.35 -55.95 12.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 C-N-CA 121.019 -0.272 . . . . 72.42 110.354 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.3 pt-20 -57.8 -30.49 65.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.81 0.338 . . . . 73.44 111.383 -178.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -94.4 6.75 47.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.334 -0.394 . . . . 72.33 111.61 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 69.0 t80 -57.81 -44.71 86.56 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.92 -0.4 . . . . 71.12 109.92 178.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.921 0.391 . . . . 72.22 110.757 176.42 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.56 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.4 p-10 . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.986 -0.376 . . . . 73.11 109.986 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -84.13 -77.29 0.27 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.58 -0.282 . . . . 52.11 111.253 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -105.34 -50.73 3.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.276 0.56 . . . . 70.52 109.845 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.56 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -97.28 161.52 13.76 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.476 -0.784 . . . . 64.32 110.863 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -78.75 53.76 1.41 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.832 -0.622 . . . . 62.34 112.091 -179.121 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.444 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 28.6 m-85 -53.79 -41.32 67.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.973 0.416 . . . . 71.41 110.961 -178.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.93 -5.02 31.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.8 -0.636 . . . . 33.14 112.24 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -99.37 -61.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.771 -0.455 . . . . 72.42 109.771 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.32 -23.51 24.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.731 -0.668 . . . . 71.03 112.682 -178.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.0 t -65.26 -25.58 67.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.473 0.178 . . . . 71.25 111.06 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.537 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.8 mt-10 -82.16 -33.23 29.62 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.519 0.676 . . . . 63.45 109.183 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.73 -45.15 91.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.913 -1.04 . . . . 72.3 109.443 177.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.505 HG23 ' HD2' ' B' ' 243' ' ' TYR . 71.9 mt -68.91 -31.38 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.615 -0.72 . . . . 63.02 110.682 176.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.48 -38.59 81.24 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.19 -0.459 . . . . 72.21 110.828 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.627 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 2.0 tm? -67.63 -39.74 84.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 64.54 110.135 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.585 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -61.2 -25.52 67.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.255 0.55 . . . . 71.55 110.739 177.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.413 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 22.8 m-80 -80.51 -19.97 44.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.987 -0.551 . . . . 54.12 110.141 178.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.627 ' HG2' ' HA ' ' A' ' 17' ' ' LEU . 27.6 mm-40 -68.33 -51.38 45.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.411 0.624 . . . . 61.2 109.522 177.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -73.82 -14.69 61.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.159 -0.928 . . . . 74.31 110.362 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -81.18 -11.64 59.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.744 -0.662 . . . . 62.34 110.854 -178.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 8.6 mm-40 -78.88 64.02 3.73 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.295 0.569 . . . . 73.22 110.352 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -147.55 149.36 32.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.502 -0.772 . . . . 74.51 109.053 -178.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.2 t -103.54 -31.77 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 111.979 0.362 . . . . 74.13 111.979 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -87.29 2.69 49.45 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.155 0.428 . . . . 73.3 112.155 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.92 148.93 16.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.8 -0.445 . . . . 71.03 109.8 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.519 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 2.3 mp0 -83.45 146.79 28.21 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.993 -0.548 . . . . 71.42 109.631 178.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 38.8 m -59.04 -34.79 72.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.125 0.488 . . . . 63.43 110.785 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.4 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -71.86 -11.57 73.94 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.746 -0.661 . . . . 54.24 113.32 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 13.3 mm-40 -74.54 -23.31 58.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.297 0.57 . . . . 74.4 110.037 -179.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.585 HG11 ' O ' ' A' ' 18' ' ' ALA . 21.2 t -87.3 -39.08 12.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.636 -0.711 . . . . 53.53 109.834 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -57.56 -42.05 82.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.688 -0.687 . . . . 24.34 110.746 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.11 -31.28 72.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 73.44 110.908 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.536 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 50.0 m -66.96 -32.3 73.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.159 0.504 . . . . 74.41 109.901 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.495 ' CD1' HD12 ' B' ' 214' ' ' LEU . 7.1 t80 -68.47 -37.68 80.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 72.52 109.854 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.779 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 8.5 ttm -66.86 -45.22 78.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 65.33 111.324 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.661 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 23.7 t-105 -63.1 -38.21 90.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.988 0.423 . . . . 71.22 110.565 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.509 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -66.39 -36.8 83.76 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.07 -0.514 . . . . 44.11 111.242 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 61.4 tp -67.68 -35.52 79.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.946 -0.391 . . . . 72.54 109.946 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.424 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.0 -43.59 98.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.81 -0.632 . . . . 73.21 110.9 178.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -69.88 -39.15 76.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.025 0.441 . . . . 75.13 110.708 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -72.41 -32.07 66.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.975 -0.557 . . . . 64.11 110.497 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 7.1 t-20 -77.31 -39.28 48.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.003 -0.544 . . . . 74.44 110.722 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.74 -27.59 69.3 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.12 0.486 . . . . 74.32 111.006 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 18.6 t90 -58.55 -27.77 64.88 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.253 -0.885 . . . . 71.52 111.072 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.83 -1.72 40.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.544 -0.298 . . . . 74.31 111.639 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.09 -27.53 69.06 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.463 -0.875 . . . . 72.3 111.37 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.58 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 33.9 p -67.34 -17.7 64.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 43.43 111.572 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 p -94.52 0.69 55.47 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.958 0.409 . . . . 54.44 110.894 -177.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.4 t -81.17 -39.03 26.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 63.11 111.59 -175.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.414 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.3 m-85 -154.13 -179.05 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.246 0.461 . . . . 73.24 112.246 -175.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 54' ' ' THR . 8.9 pt-20 -101.79 -47.32 4.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.41 -0.814 . . . . 75.13 111.284 -176.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.451 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 51.9 p -96.41 154.77 17.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.511 -0.313 . . . . 63.34 110.358 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.506 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 17.1 ptmt -68.42 -31.16 70.3 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.844 -0.343 . . . . 71.44 110.287 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.451 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.7 mp0 -58.21 -52.24 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.281 0.562 . . . . 75.32 110.606 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.681 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 21.8 mt-30 -76.91 -36.64 56.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.746 -0.661 . . . . 71.54 110.541 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.58 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 22.7 ttt -64.86 -43.36 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 70.44 111.092 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.528 ' HG3' ' NZ ' ' A' ' 62' ' ' LYS . 32.5 tt0 -61.56 -38.68 88.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.021 -0.536 . . . . 74.23 111.406 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.21 -8.7 57.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.056 -0.52 . . . . 73.4 111.714 -175.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.681 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.2 mmmm -104.02 -0.24 29.05 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 120.881 -0.328 . . . . 73.33 111.119 -175.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 6.6 ptpp? -59.52 -48.44 81.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.695 -0.402 . . . . 73.12 110.607 -176.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.592 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.1 tp60 -73.4 -24.52 60.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.961 -0.385 . . . . 64.32 109.961 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -71.35 -43.45 66.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 73.31 111.19 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.2 ptp -75.19 -34.34 61.51 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.911 -0.774 . . . . 63.11 108.911 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.411 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 63.9 mtp -82.15 1.28 37.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.508 -0.769 . . . . 74.33 111.289 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 26.1 t0 -78.86 -27.47 44.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.987 0.422 . . . . 75.33 110.512 -175.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.631 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 24.6 p90 -119.38 -8.59 10.03 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.652 -0.419 . . . . 73.1 111.258 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.2 m-30 -54.57 -48.34 72.2 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.625 0.25 . . . . 75.4 111.472 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.782 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -52.3 -57.54 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.994 -0.548 . . . . 74.45 111.54 177.875 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.493 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 9.1 t70 -91.47 62.74 4.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.952 -0.567 . . . . 61.51 111.066 -172.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 4.2 mmp_? -120.12 -38.01 2.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 73.25 110.923 175.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.822 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -90.22 12.2 18.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.129 0.49 . . . . 73.02 109.726 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -51.81 -66.86 0.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.834 -1.076 . . . . 62.11 111.098 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.0 -23.16 64.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.75 -0.659 . . . . 70.25 112.266 -174.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.434 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 28.2 mtm -78.13 -28.14 48.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.297 0.57 . . . . 71.21 109.619 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.751 HD21 ' HE2' ' A' ' 81' ' ' MET . 6.6 tt -76.08 -37.59 58.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.438 -0.801 . . . . 74.3 108.887 174.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.424 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 11.3 t70 -55.76 -39.33 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.055 -0.975 . . . . 71.42 111.069 178.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.96 -20.32 66.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.283 -0.871 . . . . 70.53 111.974 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -104.3 -4.47 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 121.065 -0.254 . . . . 54.33 111.382 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.751 ' HE2' HD21 ' A' ' 77' ' ' LEU . 9.5 mmt -71.56 -35.41 70.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.637 -0.256 . . . . 64.21 111.611 -178.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.895 ' HA ' HD12 ' A' ' 85' ' ' ILE . 41.2 mt-10 -72.58 4.03 4.34 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.003 0.371 . . . . 74.22 112.003 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.34 127.2 30.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.401 -0.592 . . . . 51.43 109.401 170.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . 0.537 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 23.0 m-85 77.5 -0.12 2.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.83 -1.077 . . . . 63.13 110.997 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 82' ' ' GLU . 11.2 mt -92.68 -66.02 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.108 -0.496 . . . . 65.51 109.687 176.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.26 -18.54 65.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.269 0.557 . . . . 63.23 110.151 176.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -100.8 0.6 39.02 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.617 -0.72 . . . . 71.22 111.152 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.76 -47.6 85.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 120.589 0.233 . . . . 75.54 110.614 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 62.11 111.412 178.983 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.592 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 84.4 m-20 . . . . . 0 N--CA 1.452 -0.335 0 CA-C-O 121.221 0.534 . . . . 72.24 111.482 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -120.68 -58.69 1.81 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.32 -0.855 . . . . 75.24 109.677 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -122.03 -49.06 2.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.104 0.478 . . . . 63.0 110.28 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -99.85 166.63 10.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.798 -0.637 . . . . 55.54 111.74 -177.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.592 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -78.84 53.99 1.47 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 74.04 111.708 178.126 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' B' ' 206' ' ' ALA . 71.1 m-85 -54.49 -45.6 73.28 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 72.21 111.753 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.5 -15.34 62.56 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.431 0.53 . . . . 62.3 112.431 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -87.74 -62.33 1.52 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.576 0.227 . . . . 75.13 110.506 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.836 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.6 -18.91 22.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.877 0.695 . . . . 65.42 112.877 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 13.6 t -66.76 -23.16 66.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.695 0.284 . . . . 73.02 110.738 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.493 ' HB2' HD11 ' A' ' 17' ' ' LEU . 79.4 mt-10 -84.55 -27.46 27.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.387 0.613 . . . . 71.53 109.379 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.836 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -67.23 -47.27 71.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.202 -0.908 . . . . 62.41 109.598 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 74.6 mt -68.9 -30.92 48.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.661 -0.699 . . . . 65.3 110.27 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' B' ' 212' ' ' THR . 10.2 tmtt? -56.31 -40.03 73.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.796 -0.638 . . . . 72.12 110.88 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -64.61 -45.21 87.9 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.576 -0.527 . . . . 73.41 109.576 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.85 -37.08 78.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.98 -0.555 . . . . 71.1 110.835 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -74.52 11.56 0.98 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.053 -0.521 . . . . 71.22 111.757 178.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.11 -37.72 6.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.16 0.505 . . . . 72.25 109.733 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -76.83 -38.32 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 71.54 110.835 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . 0.557 ' ND2' ' HA ' ' B' ' 229' ' ' THR . 3.8 t-20 -71.29 -14.59 62.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.63 -0.714 . . . . 71.22 111.55 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -74.71 1.22 12.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.453 -0.34 . . . . 60.44 111.315 -176.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.533 HD22 HG13 ' B' ' 227' ' ' ILE . 1.4 t30 -77.69 103.95 7.94 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.61 -0.885 . . . . 72.2 108.61 174.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.9 t -58.64 -36.66 74.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.594 -0.73 . . . . 72.11 112.888 -172.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -82.57 9.55 9.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.964 0.357 . . . . 74.32 111.964 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.533 HG13 HD22 ' B' ' 224' ' ' ASN . 4.5 mt -117.28 152.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 109.768 -0.456 . . . . 72.32 109.768 175.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.0 154.43 28.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.087 -0.506 . . . . 71.24 110.169 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . 0.557 ' HA ' ' ND2' ' B' ' 222' ' ' ASN . 5.5 m -64.43 -30.81 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.978 0.418 . . . . 65.05 110.501 179.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -68.05 -18.15 70.58 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.825 -0.625 . . . . 35.32 113.318 -178.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -71.23 -20.21 62.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.991 0.424 . . . . 72.05 111.078 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . 0.455 HG21 ' CA ' ' B' ' 222' ' ' ASN . 28.6 t -99.12 -36.76 5.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.085 -0.507 . . . . 70.45 110.478 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 35.9 p -64.16 -40.99 97.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.03 0.443 . . . . 64.31 110.52 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.38 73.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.989 -0.55 . . . . 61.44 110.554 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.405 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 56.4 m -68.12 -36.49 79.82 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.744 -0.465 . . . . 54.0 109.744 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.53 -40.73 85.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.751 -0.659 . . . . 75.45 109.58 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.822 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 14.8 ttm -66.25 -44.13 84.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.685 -0.689 . . . . 64.13 111.457 178.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.444 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 22.7 t-105 -64.31 -38.91 92.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.33 110.445 176.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.514 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.7 -39.08 93.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.131 -0.486 . . . . 74.2 111.065 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.17 -35.83 78.65 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.615 -0.513 . . . . 74.41 109.615 177.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -62.88 -30.65 71.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.175 -0.466 . . . . 61.44 111.406 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -88.59 -33.25 17.74 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.871 -0.332 . . . . 74.04 110.949 179.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.505 ' HD2' HG23 ' A' ' 15' ' ' ILE . 10.7 t80 -81.56 -39.64 24.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.392 -0.367 . . . . 72.4 111.233 -175.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -78.82 -17.43 55.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.047 0.451 . . . . 73.13 110.975 -175.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -74.75 -13.95 60.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.233 0.539 . . . . 70.13 110.57 177.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -60.63 -25.93 66.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.513 -0.767 . . . . 65.22 110.533 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.4 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 63.4 m-85 -72.77 -8.63 56.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.862 -0.608 . . . . 73.45 111.762 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . 0.747 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.03 -36.4 67.34 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.508 -0.853 . . . . 74.22 111.816 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 43.9 p -69.8 -13.63 62.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.815 0.34 . . . . 72.5 111.831 -177.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 40.0 p -93.03 -9.82 38.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.39 . . . . 72.41 110.784 -178.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.7 t -76.5 -36.56 57.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.244 -0.435 . . . . 51.53 110.772 -175.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.403 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 1.4 m-85 -148.88 -178.5 6.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.126 0.489 . . . . 72.01 111.919 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.527 ' HG3' HG23 ' B' ' 254' ' ' THR . 10.3 pt-20 -103.93 -33.41 8.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.136 -0.938 . . . . 74.31 111.779 -172.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.536 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 43.2 p -115.09 158.48 22.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.869 -0.605 . . . . 75.45 110.158 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.77 -36.06 79.81 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 121.052 -0.259 . . . . 63.24 110.792 -178.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . 0.536 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.6 mp0 -58.27 -50.97 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.282 0.563 . . . . 73.25 110.188 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.618 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 23.9 mt-30 -73.05 -40.86 64.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.471 -0.786 . . . . 75.21 110.82 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.448 ' SD ' HG12 ' A' ' 85' ' ' ILE . 20.1 ttt -63.88 -47.38 80.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 74.32 111.24 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.547 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.7 tt0 -62.0 -34.48 76.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 63.24 110.909 -178.191 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.32 -6.77 48.24 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.113 -0.494 . . . . 45.24 111.58 -178.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.618 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 13.9 mmmm -114.59 5.49 15.47 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 122.362 -0.211 . . . . 53.02 110.608 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.473 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 1.6 ptpp? -52.55 -48.34 66.19 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 123.314 0.384 . . . . 64.41 110.785 -177.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 16.1 tp60 -77.78 -28.36 50.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.99 0.424 . . . . 62.41 110.055 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.67 -38.17 83.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.748 -0.66 . . . . 61.1 111.187 -177.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.747 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 16.8 ptp -84.44 -26.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.307 0.575 . . . . 74.11 109.83 -177.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.523 ' HG2' HD22 ' A' ' 77' ' ' LEU . 75.0 mtp -79.1 -20.46 48.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.643 -0.708 . . . . 70.14 111.758 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.41 -34.95 74.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 75.2 111.369 -168.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -102.79 -10.61 18.97 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.787 -0.365 . . . . 74.44 111.179 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -60.35 -48.13 83.08 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.477 0.18 . . . . 51.4 111.173 -178.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.81 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -51.65 -51.77 53.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.059 -0.519 . . . . 75.52 111.088 177.067 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . 0.662 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 10.4 t70 -92.2 28.75 1.81 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.831 -0.622 . . . . 45.11 111.558 -171.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -84.28 -48.28 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.945 -0.472 . . . . 73.54 110.765 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.782 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -83.85 10.49 9.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.113 -0.494 . . . . 74.51 110.981 -174.822 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 14.4 tttp -56.07 -60.57 3.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.946 -0.57 . . . . 73.43 110.782 -177.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . 0.473 ' HG3' ' N ' ' B' ' 276' ' ' MET . 6.0 pt-20 -56.82 -39.83 74.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.602 -0.726 . . . . 74.12 111.842 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . 0.661 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 49.3 mtm -74.66 -26.21 59.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.044 0.45 . . . . 44.12 110.548 -176.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 5.2 tt -72.41 -41.69 65.96 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.711 -0.848 . . . . 75.55 108.711 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . 0.411 ' N ' ' HE1' ' A' ' 66' ' ' MET . 8.7 t70 -61.37 -38.68 87.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.237 -0.892 . . . . 71.02 110.815 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -64.39 -17.35 63.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.656 -0.702 . . . . 35.2 111.779 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -101.09 -3.37 29.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.758 0.313 . . . . 71.53 111.283 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.41 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.1 mmt -76.38 -176.03 3.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.242 -0.435 . . . . 73.42 110.675 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.769 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 4.0 mm-40 61.54 14.81 6.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.483 -0.78 . . . . 75.11 111.901 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -66.76 -58.84 4.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.201 -0.454 . . . . 63.54 110.676 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -89.29 -7.46 55.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.977 0.417 . . . . 72.54 110.002 174.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.769 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 42.7 mt -75.44 -57.88 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.087 -0.506 . . . . 74.32 111.318 -175.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.5 pt-20 -73.03 -16.71 61.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.838 0.351 . . . . 72.24 110.595 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . 0.403 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 56.4 m-80 -109.19 22.19 16.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.289 -0.414 . . . . 64.43 110.516 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.506 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 25.3 t80 -58.6 -56.78 17.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.47 -0.332 . . . . 75.33 110.826 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.536 -0.302 . . . . 73.52 111.364 -179.101 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.697 ' HA ' ' HB2' ' A' ' 8' ' ' TYR . 1.6 p-10 . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.759 -0.83 . . . . 74.31 108.759 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . 0.461 ' H ' ' HD2' ' A' ' 8' ' ' TYR . 24.8 mt-10 -104.33 79.08 1.55 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.25 -0.432 . . . . 62.03 111.544 -175.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.43 24.67 8.77 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.125 0.965 . . . . 75.22 108.735 175.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -158.3 174.91 14.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.41 -1.268 . . . . 71.03 110.222 -171.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -91.49 42.4 1.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.308 -0.405 . . . . 64.31 111.526 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.697 ' HB2' ' HA ' ' A' ' 3' ' ' ASN . 44.5 m-85 -53.34 -46.3 69.46 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.413 -0.358 . . . . 54.13 111.193 178.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.12 -14.91 62.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.95 -0.568 . . . . 51.01 111.914 -178.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.444 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 0.6 OUTLIER -95.36 -58.02 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.257 -0.275 . . . . 72.42 110.257 178.905 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.889 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -57.16 -23.14 45.44 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.688 0.625 . . . . 51.53 112.688 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 t -65.39 -24.01 67.11 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.941 0.401 . . . . 70.04 110.801 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.544 ' HB2' HD11 ' B' ' 217' ' ' LEU . 35.9 mt-10 -81.34 -23.28 37.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.332 0.586 . . . . 73.21 109.878 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.889 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -71.14 -41.68 70.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.333 -0.848 . . . . 75.03 109.591 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.425 HG23 ' HD2' ' B' ' 243' ' ' TYR . 71.4 mt -72.67 -20.58 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.657 -0.701 . . . . 75.31 110.192 177.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 15.7 mmmt -57.96 -40.08 79.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.708 -0.678 . . . . 70.31 111.851 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' B' ' 213' ' ' GLU . 2.7 tm? -74.98 -29.73 60.98 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.267 0.556 . . . . 72.44 109.527 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.418 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -70.4 -42.95 71.02 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.585 -0.734 . . . . 51.5 110.698 -175.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.655 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.8 m-20 -57.05 -42.45 80.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.893 -0.594 . . . . 64.11 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.92 -33.96 75.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.939 -0.573 . . . . 75.52 111.745 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -77.62 -27.99 51.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.001 0.429 . . . . 74.14 110.199 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.595 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 3.4 t-20 -74.7 -20.28 59.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.94 -0.573 . . . . 74.14 110.383 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 9.9 mm-40 -71.91 -15.58 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.962 -0.563 . . . . 64.22 111.296 -178.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.616 ' HB3' HG13 ' A' ' 27' ' ' ILE . 10.7 t30 -66.69 123.51 20.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.963 0.411 . . . . 61.45 110.569 -177.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.2 t -56.98 -37.2 71.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.368 -0.833 . . . . 74.24 113.039 -175.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -82.74 -24.09 33.71 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.852 0.316 . . . . 75.0 111.852 -173.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.616 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.5 mt -90.68 145.11 7.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.095 0.474 . . . . 70.12 110.276 -174.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.708 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 33.4 mt-30 -83.73 152.65 24.59 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.322 -0.854 . . . . 71.32 109.358 177.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.595 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 30.2 m -58.3 -37.7 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.033 0.445 . . . . 72.0 110.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.844 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -69.39 -19.08 74.08 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.6 -0.727 . . . . 72.25 114.078 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.708 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 33.7 mm-40 -74.92 -36.09 62.17 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 117.588 0.694 . . . . 71.31 109.606 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.498 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.5 t -71.92 -41.04 69.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.312 -0.858 . . . . 74.21 110.353 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -59.38 -37.08 77.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.714 -0.675 . . . . 73.21 110.369 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.64 -31.48 65.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.798 -0.637 . . . . 72.01 110.872 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.483 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 10.3 t -68.33 -37.54 80.64 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.694 -0.484 . . . . 72.0 109.694 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.616 ' HD1' HD12 ' B' ' 214' ' ' LEU . 13.7 t80 -66.89 -37.47 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 72.11 109.545 176.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.731 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.4 ttm -67.33 -46.63 72.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 61.02 111.412 178.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.631 ' HE3' ' HB3' ' B' ' 276' ' ' MET . 35.8 t-105 -62.24 -39.93 94.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.739 0.304 . . . . 72.32 110.727 177.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.522 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -63.14 -37.89 88.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.362 -0.381 . . . . 72.1 111.038 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.753 HD21 ' SD ' ' B' ' 237' ' ' MET . 56.4 tp -64.94 -37.93 89.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 120.955 0.407 . . . . 70.5 110.075 178.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.549 ' HB1' ' HA ' ' B' ' 277' ' ' LEU . . . -63.16 -35.41 80.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.797 -0.638 . . . . 74.43 111.25 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 38' ' ' TRP . 55.9 mtp180 -74.81 -37.45 62.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.258 0.551 . . . . 74.12 110.142 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -77.39 -41.25 40.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.471 -0.786 . . . . 75.53 110.911 -175.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -66.05 -34.74 78.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.945 -0.57 . . . . 52.41 110.862 -175.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.403 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -62.37 -11.07 13.44 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.851 -0.613 . . . . 71.21 112.471 -177.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -63.27 -26.99 69.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.666 0.27 . . . . 73.33 111.087 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -66.53 -11.87 54.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.446 -0.343 . . . . 65.22 111.856 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.48 -28.01 66.78 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.274 -0.965 . . . . 75.43 111.233 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.9 m -64.17 -15.83 60.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.474 0.31 . . . . 73.54 111.657 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.9 t -119.15 22.19 11.95 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.153 0.501 . . . . 72.14 110.698 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.1 t -84.59 -60.88 1.93 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.45 -0.341 . . . . 74.33 110.814 178.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.536 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.8 m-85 -146.48 -175.29 4.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.814 0.34 . . . . 75.32 111.387 -177.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -102.1 -33.13 9.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.575 -0.739 . . . . 61.03 111.241 -174.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 p -113.01 153.02 28.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.897 -0.592 . . . . 73.01 110.804 -178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -67.37 -34.04 76.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.403 -0.362 . . . . 64.1 110.755 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.23 -36.44 84.15 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.247 -0.433 . . . . 53.04 111.001 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.663 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 mt-30 -84.84 -40.16 17.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.448 -0.342 . . . . 62.35 110.468 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' HG12 ' B' ' 285' ' ' ILE . 19.4 ttt -64.4 -45.1 89.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.234 -0.439 . . . . 73.01 111.425 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.603 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.2 tt0 -64.25 -33.44 75.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 63.33 110.993 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.47 -17.84 62.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.238 -0.437 . . . . 74.33 110.898 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.663 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.3 mmmt -100.44 -2.3 33.62 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.262 -0.426 . . . . 54.22 109.904 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.594 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 27.2 ttpp -53.54 -51.77 61.84 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.239 -0.437 . . . . 41.41 111.31 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -80.41 -11.22 59.72 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.318 -0.553 . . . . 65.32 110.45 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -83.49 -27.78 29.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.312 -0.404 . . . . 74.21 110.012 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.594 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 19.0 ptp -88.9 -33.23 17.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.353 -0.981 . . . . 71.45 108.353 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 61.6 mtp -85.56 14.66 5.34 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 115.402 -0.817 . . . . 74.14 111.144 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -87.37 -39.57 15.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.182 0.515 . . . . 54.22 110.321 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.646 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 39.2 p90 -103.59 -9.89 18.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.098 -0.501 . . . . 73.42 111.758 -173.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.416 ' O ' ' HE1' ' B' ' 237' ' ' MET . 11.6 m-30 -56.74 -48.94 76.67 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.864 0.364 . . . . 63.44 110.902 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.869 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.24 -47.03 72.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.53 0.681 . . . . 74.41 110.101 176.459 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -82.93 34.49 0.45 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.017 -0.992 . . . . 73.15 110.975 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.682 ' NE ' ' HA ' ' A' ' 72' ' ' ARG . 2.1 mmp_? -107.76 -32.57 7.57 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.982 -0.449 . . . . 75.23 110.995 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.805 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -107.08 3.61 26.04 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.348 -0.541 . . . . 72.13 110.027 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.433 ' HB2' ' HG2' ' B' ' 270' ' ' MET . 82.2 tttt -63.96 -54.04 40.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.025 -0.534 . . . . 53.4 110.748 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -62.6 -24.79 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.906 -0.588 . . . . 63.54 111.499 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.613 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 64.1 mtm -90.89 -23.0 20.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.022 0.439 . . . . 73.12 110.456 -179.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.421 HD13 ' HE1' ' B' ' 270' ' ' MET . 6.2 tt -73.16 -38.65 66.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.755 -0.832 . . . . 72.1 108.755 176.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.439 ' N ' ' HE1' ' B' ' 266' ' ' MET . 26.8 t70 -60.32 -31.88 70.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.321 -0.854 . . . . 72.15 110.588 178.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.59 -14.29 60.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.602 -0.726 . . . . 62.1 111.621 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -97.44 -9.96 26.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.224 0.535 . . . . 71.13 110.641 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.45 -169.64 1.05 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.891 -0.595 . . . . 74.34 110.276 174.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.556 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 64.17 -11.03 0.13 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.876 1.065 . . . . 64.32 113.876 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -53.57 -62.64 1.52 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.735 0.302 . . . . 52.33 111.457 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -81.99 5.68 18.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.756 0.313 . . . . 72.51 111.019 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.595 HG21 ' HB2' ' B' ' 259' ' ' GLN . 51.6 mt -97.74 -59.7 3.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.42 -0.354 . . . . 73.53 111.258 -175.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.4 pt-20 -71.88 -18.49 62.04 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.567 -0.453 . . . . 73.44 110.884 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -97.37 1.39 49.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.278 -0.419 . . . . 64.24 110.481 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -63.01 -38.43 91.18 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.658 -0.497 . . . . 70.32 109.658 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 . . . . . 0 N--CA 1.465 0.276 0 CA-C-N 115.622 -0.717 . . . . 64.51 110.432 174.225 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 26.1 p-10 . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 120.689 0.28 . . . . 73.25 110.458 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . 0.529 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . 42.3 tt0 -114.2 74.27 0.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.168 0.508 . . . . 54.1 110.545 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 68.55 19.95 8.53 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.095 -0.957 . . . . 71.12 109.54 173.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.514 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -151.53 167.04 29.29 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.291 -0.868 . . . . 74.43 111.325 -170.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.483 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -90.59 45.65 1.28 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.811 -0.631 . . . . 71.34 111.066 -179.154 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.529 ' CE2' ' HB3' ' B' ' 204' ' ' GLU . 69.3 m-85 -49.07 -49.54 41.05 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.357 -0.383 . . . . 62.35 111.476 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.44 -34.8 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.142 -0.481 . . . . 70.52 111.819 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 10.5 mmp_? -68.69 -59.27 3.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.462 -0.335 . . . . 62.25 110.223 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.77 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -61.92 -17.66 57.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.888 -0.597 . . . . 72.33 111.593 -176.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 24.3 m -60.43 -34.4 73.93 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.633 -0.712 . . . . 70.21 110.921 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.537 ' HB2' HD11 ' A' ' 17' ' ' LEU . 32.2 mt-10 -81.1 -25.42 36.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 61.14 110.18 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.77 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.7 mm? -66.52 -41.22 89.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.641 -0.708 . . . . 74.53 110.209 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 93.2 mt -73.99 -18.58 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.898 -0.592 . . . . 64.51 111.194 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 212' ' ' THR . 31.2 mmmt -62.47 -40.53 96.95 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.042 -0.411 . . . . 71.1 111.043 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.2 tm? -65.79 -34.78 78.96 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.391 -0.596 . . . . 71.52 109.391 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.14 93.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.885 -0.598 . . . . 74.42 110.36 -178.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.563 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 24.4 m-80 -60.84 -35.07 75.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.961 -0.563 . . . . 73.43 110.678 178.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.08 -28.69 63.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 75.22 111.663 -179.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -84.22 -22.66 30.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.403 0.621 . . . . 53.24 110.032 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . 0.478 ' HA ' HG21 ' B' ' 232' ' ' VAL . 3.3 t-20 -75.84 -8.56 57.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.271 -0.877 . . . . 73.21 109.94 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.563 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 10.9 mm-40 -83.32 1.23 42.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.793 -0.64 . . . . 55.51 110.653 177.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.451 HD22 HG13 ' B' ' 227' ' ' ILE . 1.0 OUTLIER -89.33 111.62 22.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.356 -0.383 . . . . 73.12 110.157 -178.306 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.0 t -65.59 -36.69 84.5 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.986 0.736 . . . . 74.44 112.986 -173.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.69 -9.94 59.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.091 0.404 . . . . 54.41 112.091 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.563 HG22 ' HB2' ' B' ' 231' ' ' GLU . 7.0 mt -101.15 145.06 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.541 -0.54 . . . . 43.31 109.541 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.75 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 38.0 mt-30 -78.55 150.45 32.83 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.958 -0.564 . . . . 75.33 109.726 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -35.92 72.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.912 0.387 . . . . 40.45 110.519 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.71 -16.5 76.14 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.791 -0.641 . . . . 64.15 113.355 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.75 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 9.3 mm-40 -76.87 -31.33 56.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 117.477 0.639 . . . . 72.21 110.103 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . 0.478 HG21 ' HA ' ' B' ' 222' ' ' ASN . 22.0 t -72.05 -31.51 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.699 0.761 . . . . 62.44 109.762 178.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.14 -29.47 66.4 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.521 -0.763 . . . . 73.35 109.665 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.39 -33.41 37.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.592 -0.731 . . . . 65.22 111.424 -177.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 10.5 p -66.53 -36.74 83.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.096 -0.335 . . . . 71.2 110.096 178.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.57 ' CD1' HD12 ' A' ' 14' ' ' LEU . 3.2 t80 -65.78 -38.06 87.99 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.381 -0.6 . . . . 71.04 109.381 174.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.805 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.2 tpt -61.4 -54.38 44.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.232 -0.894 . . . . 72.43 110.639 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.613 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 27.2 t-105 -64.01 -36.58 84.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.517 -0.765 . . . . 71.31 111.421 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -62.01 -43.46 98.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.658 0.266 . . . . 72.11 110.744 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.01 -37.94 89.2 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.481 -0.327 . . . . 71.42 110.446 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.551 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -57.91 -39.99 79.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.475 -0.33 . . . . 51.03 111.347 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -75.02 -43.14 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.306 0.574 . . . . 74.42 110.283 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.425 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.5 t80 -69.81 -30.25 67.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.497 -0.774 . . . . 71.5 110.895 -175.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -79.87 -38.52 32.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.045 -0.525 . . . . 73.43 111.082 -175.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.14 -18.52 48.2 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.97 -0.559 . . . . 64.14 111.834 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -54.79 -34.22 62.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.789 -0.641 . . . . 63.42 111.227 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.844 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 41.5 m-85 -67.5 -15.08 63.48 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 112.12 0.415 . . . . 75.35 112.12 -176.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . 0.639 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -55.99 -31.09 58.33 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.596 -0.812 . . . . 54.1 112.143 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 62.2 p -74.19 -14.23 60.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.722 0.296 . . . . 74.43 111.455 -177.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 34.0 p -98.21 -5.96 32.24 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.848 0.356 . . . . 63.21 111.119 -176.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 67.3 m -78.89 -41.97 28.38 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 116.137 -0.483 . . . . 73.41 111.647 -175.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.627 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 3.0 m-85 -147.06 176.61 9.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.235 0.457 . . . . 71.03 112.235 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -101.09 -46.6 5.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.36 -0.836 . . . . 75.55 111.611 -172.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 40.9 p -100.63 151.19 21.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.52 -0.309 . . . . 65.13 110.287 -177.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -63.29 -36.29 83.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.126 -0.488 . . . . 74.51 111.075 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.74 -29.36 69.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.027 -0.533 . . . . 73.04 111.075 -176.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.758 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 25.6 mt-30 -91.25 -45.04 8.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 70.34 110.159 177.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 16.8 ttt -60.5 -41.93 95.3 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.952 -0.567 . . . . 73.14 111.552 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.595 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.6 tt0 -64.48 -40.09 95.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.83 0.348 . . . . 74.13 111.329 -178.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.54 -4.78 24.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.174 0.512 . . . . 52.01 110.954 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.758 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 71.9 mmtt -108.35 4.85 24.93 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.059 -0.519 . . . . 71.22 110.61 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.594 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 2.6 ptpp? -60.18 -49.46 77.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.399 -0.52 . . . . 72.32 110.225 -177.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.569 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 7.2 tp-100 -86.02 -1.32 57.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.555 0.693 . . . . 72.34 110.074 -179.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' B' ' 261' ' ' LYS . 4.1 tp10 -79.74 -43.44 22.59 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.821 -0.627 . . . . 74.22 109.324 173.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.639 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 3.8 ptt? -86.37 -31.62 21.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.941 0.4 . . . . 74.14 110.204 177.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.44 ' HB2' ' HA ' ' B' ' 263' ' ' GLN . 60.6 mtp -77.31 7.84 4.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.403 -0.362 . . . . 64.52 110.952 177.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -78.79 -42.6 27.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.095 0.474 . . . . 61.22 110.067 176.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.9 p90 -107.65 -12.93 15.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 73.32 111.751 -172.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 -51.88 -51.6 55.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.791 0.329 . . . . 74.31 111.199 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.869 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.87 -49.04 78.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.365 0.603 . . . . 72.22 110.228 177.316 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -87.27 42.02 1.01 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.207 -0.906 . . . . 61.33 110.647 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -104.61 -42.3 5.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.419 -0.355 . . . . 60.43 110.455 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.731 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -93.32 9.65 35.4 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.503 -0.479 . . . . 65.2 110.769 -175.531 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -63.93 -48.75 75.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.929 0.395 . . . . 60.44 110.426 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -67.66 -25.88 65.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.448 0.642 . . . . 75.03 110.737 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . 0.631 ' HB3' ' HE3' ' A' ' 38' ' ' TRP . 56.0 mmm -83.45 -28.12 29.01 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.265 -0.88 . . . . 74.02 109.792 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.549 ' HA ' ' HB1' ' A' ' 41' ' ' ALA . 1.9 tt -72.62 -41.74 65.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.353 -0.84 . . . . 64.12 108.946 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -61.01 -31.43 71.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.504 -0.771 . . . . 73.31 110.123 176.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -71.94 -7.52 49.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.265 -0.88 . . . . 75.21 111.848 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -114.35 -8.22 12.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.95 0.405 . . . . 74.43 110.96 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.511 ' C ' ' H ' ' B' ' 283' ' ' ASP . 39.9 mtt -87.85 -162.77 0.85 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.269 -0.423 . . . . 73.13 110.248 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 5.0 mm-40 65.43 -22.9 0.09 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.79 0.836 . . . . 74.25 112.75 -176.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . 0.511 ' H ' ' C ' ' B' ' 281' ' ' MET . 20.6 t70 -48.03 -63.48 1.06 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.322 0.649 . . . . 71.32 111.883 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -68.0 -32.15 72.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.029 0.442 . . . . 54.43 110.813 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.603 HG21 ' HB2' ' A' ' 59' ' ' GLN . 46.0 mt -65.25 -56.96 12.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.666 -0.697 . . . . 75.23 111.52 -173.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 13.4 pt-20 -65.72 -21.01 66.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.848 0.356 . . . . 74.2 110.906 -177.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -102.1 9.18 40.47 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 74.33 112.272 -177.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -58.38 -52.94 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.53 -0.468 . . . . 72.13 110.325 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 52.33 110.954 178.246 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.9 p-10 . . . . . 0 N--CA 1.45 -0.46 0 N-CA-C 109.29 -0.633 . . . . 62.42 109.29 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -63.8 -57.59 9.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.613 -0.721 . . . . 74.12 110.517 -178.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -136.96 -56.61 0.72 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.987 0.423 . . . . 74.42 109.998 175.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -68.25 167.1 15.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.78 -0.646 . . . . 60.33 111.652 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.406 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -79.1 49.56 0.96 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.219 -0.9 . . . . 72.34 111.845 -178.127 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.411 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 54.2 m-85 -53.31 -42.42 66.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 73.4 110.972 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.4 -9.38 47.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.68 -0.691 . . . . 74.44 112.222 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.509 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -98.54 -62.21 1.27 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.745 -0.465 . . . . 74.21 109.745 178.598 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.721 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.24 -23.88 24.8 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.743 0.646 . . . . 73.44 112.743 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.7 t -66.43 -24.92 66.53 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.738 0.304 . . . . 72.4 110.887 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.59 ' HB2' HD11 ' B' ' 217' ' ' LEU . 31.2 mt-10 -80.75 -31.17 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.481 0.658 . . . . 63.21 109.528 -177.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -67.16 -48.73 67.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.03 -0.986 . . . . 75.02 110.144 -178.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.451 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.0 mt -65.82 -29.11 45.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 74.4 110.53 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -25.88 65.37 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.98 -0.555 . . . . 71.43 110.681 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.564 HD12 HD13 ' B' ' 214' ' ' LEU . 2.4 tm? -75.42 -45.94 35.76 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.86 -0.792 . . . . 45.52 108.86 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.45 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -59.87 -37.54 79.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.519 0.676 . . . . 73.21 109.692 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 7.7 t-20 -56.58 -30.39 63.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.775 -1.102 . . . . 51.14 110.529 177.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -78.24 -35.07 48.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.772 . . . . 73.34 110.992 -176.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -79.2 -23.33 43.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.999 -176.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.416 HD22 ' HA ' ' A' ' 22' ' ' ASN . 2.8 t-20 -86.89 7.51 26.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.238 0.542 . . . . 72.43 110.499 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 87.0 mm-40 -79.3 8.24 6.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 72.42 111.184 177.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.745 ' HB3' HG13 ' A' ' 27' ' ' ILE . 3.3 t30 -101.94 111.9 24.33 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.426 -0.583 . . . . 73.13 109.426 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.6 t -56.03 -33.51 64.99 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.382 -0.826 . . . . 65.45 112.626 -175.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -95.68 13.79 25.23 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.438 0.533 . . . . 75.14 112.438 -173.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.745 HG13 ' HB3' ' A' ' 24' ' ' ASN . 5.7 mt -111.78 150.25 14.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.542 -0.54 . . . . 74.14 109.542 172.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.858 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 42.6 mt-30 -72.47 144.26 48.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.958 -0.564 . . . . 74.25 109.976 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 m -63.66 -26.32 68.61 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.228 -0.656 . . . . 61.12 109.228 175.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.47 ' HA2' ' OG ' ' A' ' 33' ' ' SER . . . -78.65 -8.03 87.87 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.195 -0.912 . . . . 63.1 113.122 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.858 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 12.6 mm-40 -78.64 -25.72 45.04 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.437 0.619 . . . . 72.53 109.859 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.45 HG11 ' O ' ' A' ' 18' ' ' ALA . 16.2 t -93.46 -31.49 4.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.353 -0.84 . . . . 70.44 110.762 -176.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.47 ' OG ' ' HA2' ' A' ' 30' ' ' GLY . 10.2 p -66.71 -37.15 84.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.245 0.545 . . . . 64.24 109.844 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.9 65.05 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.474 -0.785 . . . . 73.44 111.446 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.51 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 20.1 p -70.54 -31.79 68.97 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.905 0.383 . . . . 53.41 110.187 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.591 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.9 t80 -68.81 -41.35 78.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.879 -0.6 . . . . 72.21 109.456 174.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.752 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.1 ttm -64.06 -47.42 80.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.549 -0.75 . . . . 75.32 111.158 177.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.7 t-105 -61.31 -37.43 83.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.067 0.46 . . . . 75.44 110.751 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.572 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -68.93 -34.13 74.87 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.277 -0.42 . . . . 63.4 111.199 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.608 HD21 ' SD ' ' B' ' 237' ' ' MET . 48.8 tp -68.9 -35.94 77.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.017 0.437 . . . . 74.4 110.222 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.03 -42.87 99.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.869 -0.605 . . . . 53.22 110.72 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.409 ' NH2' HD12 ' B' ' 215' ' ' ILE . 47.7 mtm180 -71.94 -19.98 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 71.23 111.036 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -89.18 -42.13 11.84 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.307 -0.406 . . . . 63.01 110.462 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -69.71 -23.54 63.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 71.11 111.568 -179.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.37 61.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.144 0.497 . . . . 73.24 111.477 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -68.63 -31.46 70.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.025 -0.534 . . . . 71.43 110.881 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.453 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 91.1 m-85 -79.01 2.37 20.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.187 -0.461 . . . . 73.44 112.049 -173.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.445 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -59.03 -34.51 79.48 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.486 -0.864 . . . . 72.23 112.101 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.7 p -74.36 -14.83 60.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.765 0.317 . . . . 52.31 111.597 -177.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -88.5 -4.04 58.69 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.734 -0.386 . . . . 54.43 110.713 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.0 t -84.82 -36.97 21.28 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.371 -0.377 . . . . 74.14 110.756 -176.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -151.5 178.2 9.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.98 0.419 . . . . 75.41 111.311 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.407 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.5 pt-20 -99.43 -50.11 4.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.581 -0.736 . . . . 75.11 110.985 -176.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.407 HG23 ' HG3' ' A' ' 53' ' ' GLU . 63.0 p -92.25 150.52 20.83 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.156 -0.475 . . . . 74.13 110.323 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.426 ' HE2' ' HB2' ' A' ' 55' ' ' LYS . 11.2 ptmm? -68.09 -27.98 66.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.714 -0.394 . . . . 73.31 110.142 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.401 ' H ' ' CD ' ' A' ' 56' ' ' GLU . 1.7 mp0 -56.15 -54.84 40.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 73.32 110.465 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.4 mt-30 -77.38 -34.43 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.824 -0.625 . . . . 62.34 110.31 -177.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.421 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 20.4 ttt -63.68 -44.61 93.19 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.467 -0.788 . . . . 63.42 111.079 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.507 ' O ' ' HD2' ' A' ' 62' ' ' LYS . 35.6 tt0 -68.47 -28.6 67.18 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 73.34 111.234 -176.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.6 -6.68 51.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.494 -0.321 . . . . 44.53 111.801 -177.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.561 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 11.3 mmmm -112.83 10.06 19.06 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.683 -0.488 . . . . 72.41 109.683 -176.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HD2' ' O ' ' A' ' 59' ' ' GLN . 9.6 ptmt -51.27 -41.16 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.379 -0.828 . . . . 65.13 111.421 -177.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 63' ' ' GLN . 11.1 tp60 -87.76 -30.39 20.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.512 0.196 . . . . 74.11 110.622 -175.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.08 -37.17 86.14 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 116.377 -0.374 . . . . 71.03 111.302 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.451 ' HA ' ' CE2' ' A' ' 68' ' ' TYR . 23.2 ptp -83.27 -31.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.77 -0.826 . . . . 73.15 108.77 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.529 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 21.3 mtp -86.63 33.86 0.65 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.306 -0.861 . . . . 73.44 112.456 -176.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -129.13 -46.27 1.23 Allowed 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.165 -0.614 . . . . 74.43 109.949 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.451 ' CE2' ' HA ' ' A' ' 65' ' ' MET . 16.3 p90 -72.42 -17.07 61.83 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.742 -0.383 . . . . 71.23 110.028 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.724 ' HA ' ' HD3' ' A' ' 72' ' ' ARG . 6.2 m-30 -58.21 -50.5 73.33 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.766 -0.457 . . . . 74.53 109.766 174.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.65 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.36 -47.11 79.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.669 0.747 . . . . 71.33 109.467 174.444 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -80.0 31.42 0.26 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.58 -1.191 . . . . 73.13 111.437 -176.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.724 ' HD3' ' HA ' ' A' ' 69' ' ' TYR . 4.8 mtp180 -103.19 -29.75 11.11 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.662 -0.649 . . . . 72.32 111.452 -176.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.914 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -115.95 14.65 16.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.325 -0.55 . . . . 74.24 111.493 -177.746 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -63.34 -50.83 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.457 -0.572 . . . . 74.23 109.457 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.9 -30.79 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.841 -0.618 . . . . 73.42 111.272 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.4 mtt -69.46 -41.25 76.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.235 0.54 . . . . 72.33 109.571 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tt -68.92 -31.78 70.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.99 -1.005 . . . . 74.41 109.095 -179.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.569 ' N ' ' HE1' ' B' ' 266' ' ' MET . 16.1 t70 -61.86 -34.4 75.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.112 -0.949 . . . . 73.23 110.912 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.05 -4.2 46.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 52.22 111.1 -178.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.23 -31.18 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.099 0.476 . . . . 74.4 109.85 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.584 ' HG3' ' SD ' ' B' ' 266' ' ' MET . 25.0 mmt -68.82 176.32 3.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.457 -0.792 . . . . 74.32 110.663 174.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.587 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 9.6 mm-40 65.29 -30.6 0.13 Allowed 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.331 1.053 . . . . 73.42 113.19 -177.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 81' ' ' MET . 22.7 t70 -57.76 -64.02 1.04 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.9 0.381 . . . . 73.32 110.851 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -68.15 -14.66 63.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.379 . . . . 71.32 110.953 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.587 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 63.3 mt -81.49 -57.71 4.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 65.42 111.025 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.5 pt-20 -58.48 -34.68 71.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.931 0.396 . . . . 72.23 110.428 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.427 ' N ' ' HG3' ' A' ' 86' ' ' GLU . 50.6 m-80 -88.11 -0.55 57.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.049 -0.523 . . . . 74.43 111.462 -177.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.472 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 83.9 t80 -61.34 -43.51 98.75 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 120.4 -0.52 . . . . 63.34 109.863 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.2 t70 . . . . . 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 64.22 110.238 176.87 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.544 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.2 p-10 . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 121.13 0.491 . . . . 72.54 111.114 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -81.39 -90.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.805 -0.634 . . . . 72.42 111.365 -175.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -102.53 -36.83 8.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.285 0.564 . . . . 54.45 109.846 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.544 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -97.82 150.75 20.93 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.473 -0.785 . . . . 74.41 110.74 176.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.51 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -75.85 54.77 0.84 Allowed 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.659 -1.155 . . . . 63.35 112.121 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -52.8 -43.39 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.414 -0.357 . . . . 74.21 111.094 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -68.03 -10.77 56.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.824 -0.625 . . . . 70.55 112.086 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.561 ' HA ' ' HE ' ' B' ' 210' ' ' ARG . 1.1 mmp_? -96.13 -60.83 1.55 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.921 -0.4 . . . . 70.53 109.921 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.719 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.24 -20.6 28.4 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.807 0.669 . . . . 65.41 112.807 -176.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.26 -24.54 65.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.794 0.33 . . . . 71.23 111.038 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.475 ' HB2' HD11 ' A' ' 17' ' ' LEU . 41.8 mt-10 -87.34 -24.04 24.41 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.13 0.491 . . . . 75.32 109.962 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.719 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.8 mm? -68.88 -49.1 61.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.538 -0.755 . . . . 63.42 110.334 -178.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.572 HG13 ' HB1' ' A' ' 39' ' ' ALA . 65.2 mt -68.86 -25.23 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.01 0.433 . . . . 74.41 110.385 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.514 ' HD3' HE22 ' B' ' 220' ' ' GLN . 0.9 OUTLIER -59.0 -36.07 74.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.048 -0.524 . . . . 53.44 110.439 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.3 tm? -65.89 -43.55 87.95 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.096 -0.705 . . . . 74.03 109.096 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.09 66.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 74.44 110.678 178.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 12.6 m120 -62.09 -35.09 77.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.008 -0.542 . . . . 75.33 110.247 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . 0.514 HE22 ' HD3' ' B' ' 216' ' ' LYS . 2.6 mp0 -74.33 -24.96 59.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.195 -0.457 . . . . 65.4 111.216 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . 0.428 ' HB2' HG13 ' B' ' 232' ' ' VAL . 62.7 mt-30 -86.85 -27.43 23.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.994 0.426 . . . . 72.34 110.33 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.17 -1.88 46.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.859 -0.61 . . . . 71.52 110.744 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.8 mm-40 -69.96 -17.52 63.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.108 0.48 . . . . 74.22 110.388 176.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.699 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -79.6 124.53 28.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.965 -0.561 . . . . 73.34 110.109 176.101 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.7 t -99.86 -17.32 17.69 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.09 -0.505 . . . . 71.41 110.232 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . 0.699 ' HG2' HD22 ' B' ' 224' ' ' ASN . 2.0 pm0 -80.64 -6.42 58.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 75.54 110.932 176.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.425 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.2 mt -111.96 153.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.467 -0.568 . . . . 74.03 109.467 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.19 142.21 49.05 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.064 -0.347 . . . . 45.54 110.064 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.1 m -62.22 -24.08 67.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.523 0.678 . . . . 75.43 109.981 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . 0.453 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.32 -32.16 83.28 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.383 -0.826 . . . . 25.0 112.676 178.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -65.09 -32.54 74.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.889 0.376 . . . . 75.43 110.673 -177.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . 0.428 HG13 ' HB2' ' B' ' 221' ' ' GLN . 11.8 t -75.09 -29.27 21.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 74.14 110.657 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 72.3 p -74.63 -24.96 58.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.437 0.637 . . . . 63.3 109.493 175.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.81 -33.91 34.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.446 -0.797 . . . . 64.22 110.906 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 5.3 p -67.61 -36.63 81.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 120.898 0.38 . . . . 65.14 110.071 177.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.589 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 2.1 t80 -68.39 -36.01 78.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 74.23 109.406 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.914 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.3 tpt -63.31 -56.41 16.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.251 -0.886 . . . . 62.25 110.527 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.3 t-105 -60.53 -35.61 76.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.206 -0.906 . . . . 72.2 111.103 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.42 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.99 -43.22 88.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.418 -0.355 . . . . 74.3 111.338 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.18 -34.81 78.45 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.733 0.301 . . . . 70.41 110.489 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.9 79.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 73.22 111.102 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . 0.422 HH21 HD12 ' A' ' 15' ' ' ILE . 28.6 mtm180 -70.45 -27.81 64.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 75.04 111.125 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.451 ' HD2' HG23 ' A' ' 15' ' ' ILE . 8.8 t80 -80.86 -34.86 33.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 72.3 110.349 -178.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -75.95 -35.82 59.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.029 -0.532 . . . . 71.1 110.852 -176.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.37 -22.69 63.59 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.967 -0.561 . . . . 73.34 111.798 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.5 t90 -55.19 -33.86 63.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.99 -0.55 . . . . 75.32 111.443 179.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -74.58 -7.46 53.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 75.34 111.975 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -65.14 -34.59 90.08 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.271 -0.966 . . . . 74.31 111.491 176.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.2 m -71.22 -9.69 58.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.76 0.314 . . . . 70.34 111.681 -177.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.4 t -119.74 16.77 12.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 74.53 110.388 178.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.6 t -90.22 -27.45 19.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.054 0.454 . . . . 72.0 109.941 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -146.06 170.41 16.71 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.222 -0.659 . . . . 73.42 109.222 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.553 ' HG3' HG23 ' B' ' 254' ' ' THR . 10.1 pt-20 -89.41 -37.38 14.87 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.787 -0.365 . . . . 64.53 111.557 -175.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.553 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.7 p -110.94 159.75 17.43 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 123.166 0.292 . . . . 63.01 110.535 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.614 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 12.0 ptmm? -74.79 -26.14 59.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.847 -0.427 . . . . 72.44 109.847 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -54.47 -42.7 70.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 72.43 110.619 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' B' ' 261' ' ' LYS . 15.9 mt-30 -91.48 -37.12 13.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.763 -0.653 . . . . 70.45 110.394 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.614 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 17.9 ttt -60.56 -40.85 93.14 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.078 -0.51 . . . . 63.41 111.712 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.472 ' HB2' HG21 ' A' ' 85' ' ' ILE . 31.5 tt0 -72.33 -31.17 65.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.067 -0.515 . . . . 73.31 111.844 -174.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -79.31 -13.42 59.66 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.266 0.555 . . . . 61.02 110.984 -167.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.577 ' C ' ' HD3' ' B' ' 261' ' ' LYS . 0.0 OUTLIER -126.78 26.37 6.22 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 115.67 -0.695 . . . . 74.53 112.138 -175.512 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.651 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 0.0 OUTLIER -59.17 -35.0 72.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.095 -0.502 . . . . 74.12 109.907 175.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.408 ' N ' ' HG2' ' B' ' 262' ' ' LYS . 12.7 tp60 -73.09 -25.56 60.93 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.329 -0.396 . . . . 74.43 111.434 -176.31 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . 0.45 ' OE1' ' HB2' ' B' ' 261' ' ' LYS . 40.5 mt-10 -57.47 -55.16 38.37 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.219 0.533 . . . . 73.23 110.309 176.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.705 ' HA ' ' CE2' ' B' ' 268' ' ' TYR . 2.2 ptt? -72.33 -34.79 68.32 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.955 -0.566 . . . . 74.22 109.909 -177.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.584 ' SD ' ' HG3' ' A' ' 81' ' ' MET . 26.5 mtp -79.98 19.36 0.71 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.923 -0.581 . . . . 74.52 111.639 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.98 -44.06 3.06 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.574 -0.528 . . . . 73.33 109.574 175.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.705 ' CE2' ' HA ' ' B' ' 265' ' ' MET . 20.7 p90 -91.27 -19.41 23.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.016 -0.538 . . . . 73.53 111.561 -178.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.427 ' CE2' ' HB2' ' B' ' 265' ' ' MET . 1.6 m-30 -52.76 -48.17 66.96 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.825 0.345 . . . . 70.41 110.763 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.65 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -54.05 -47.97 71.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.598 -0.728 . . . . 53.33 111.217 178.353 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.66 26.88 2.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.376 -0.829 . . . . 72.21 111.765 -168.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 12.0 mtp180 -95.66 -26.86 15.56 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.485 -0.486 . . . . 64.32 111.626 -178.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.752 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.06 11.1 37.64 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.523 -0.471 . . . . 71.21 110.45 -178.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.431 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.6 ttmt -65.01 -43.35 92.79 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.119 -0.491 . . . . 71.21 110.403 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.43 -39.47 93.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.651 0.263 . . . . 45.35 111.418 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.5 mtt -61.31 -46.24 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.453 0.644 . . . . 70.31 109.727 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.444 ' CD2' ' HE2' ' B' ' 281' ' ' MET . 1.1 tt -67.58 -33.25 74.65 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.784 -1.098 . . . . 61.44 109.663 -178.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . 0.529 ' N ' ' HE1' ' A' ' 66' ' ' MET . 19.6 t70 -64.86 -28.38 69.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.253 -0.885 . . . . 74.43 110.425 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -90.33 -2.39 57.99 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.261 -0.881 . . . . 62.14 111.092 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -104.91 -23.76 12.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 72.11 110.507 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.444 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.3 mmt -69.31 179.18 2.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.537 0.684 . . . . 71.21 111.672 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.722 ' HA ' HD12 ' B' ' 285' ' ' ILE . 30.2 mt-10 68.63 -12.29 0.37 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.326 -1.306 . . . . 64.41 112.97 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.96 -58.93 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 72.21 110.395 177.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -72.65 -16.06 61.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.165 -0.471 . . . . 75.22 110.885 178.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.722 HD12 ' HA ' ' B' ' 282' ' ' GLU . 60.9 mt -77.54 -57.08 6.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.116 -0.493 . . . . 73.13 110.551 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.2 pt-20 -67.34 -25.26 65.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 52.24 110.809 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -94.99 15.75 17.99 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.179 -0.464 . . . . 74.2 111.519 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -58.12 -50.09 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.198 -0.667 . . . . 75.13 109.198 173.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.4 t70 . . . . . 0 N--CA 1.466 0.334 0 CA-C-N 115.667 -0.697 . . . . 71.42 111.33 175.112 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.753 ' ND2' ' HA ' ' A' ' 7' ' ' PHE . 89.1 m-20 . . . . . 0 CA--C 1.519 -0.249 0 CA-C-O 121.116 0.484 . . . . 75.44 111.208 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -97.31 -80.58 0.44 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.4 -0.963 . . . . 71.14 108.4 168.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -113.6 -47.63 2.98 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.897 -0.779 . . . . 72.45 108.897 170.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -82.82 159.49 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.408 -0.815 . . . . 64.32 111.835 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.753 ' HA ' ' ND2' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -75.82 56.36 0.94 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.87 -1.059 . . . . 65.1 112.309 179.272 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.451 ' HE1' ' HZ2' ' B' ' 238' ' ' TRP . 58.5 m-85 -56.2 -44.35 79.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.514 -0.312 . . . . 73.42 111.419 -179.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.61 61.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.339 -0.391 . . . . 70.33 111.627 -177.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -88.18 -65.23 1.04 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.397 -0.365 . . . . 72.12 110.099 177.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.693 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -58.64 -21.94 55.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 112.68 0.622 . . . . 72.01 112.68 -175.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.642 HG23 ' HG2' ' A' ' 13' ' ' GLU . 6.1 t -59.41 -28.91 67.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.136 0.494 . . . . 71.21 110.814 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.642 ' HG2' HG23 ' A' ' 12' ' ' THR . 5.4 mm-40 -92.31 -26.3 18.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.874 -0.603 . . . . 71.43 110.171 -173.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.693 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -64.51 -45.03 89.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.298 -0.864 . . . . 62.53 109.178 173.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.519 HG13 ' HB1' ' B' ' 239' ' ' ALA . 89.4 mt -69.24 -34.76 64.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.689 -0.687 . . . . 73.11 110.373 175.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -64.22 -30.83 71.87 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.849 -0.614 . . . . 64.02 111.351 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.59 HD12 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -65.04 -41.85 94.85 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.946 -0.761 . . . . 70.31 108.946 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.94 70.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.378 -0.828 . . . . 74.54 110.865 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -63.47 -26.36 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.817 -0.628 . . . . 64.21 110.978 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.417 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 2.7 mp0 -85.35 -8.61 58.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.207 -0.451 . . . . 75.43 111.194 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.428 ' OE1' HD21 ' B' ' 214' ' ' LEU . 80.8 mt-30 -104.68 -29.27 10.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.82 0.343 . . . . 74.15 110.498 177.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.423 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 2.5 t-20 -83.08 -12.47 57.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.037 0.446 . . . . 73.44 110.569 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.417 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.9 pt20 -73.45 -1.01 16.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.175 0.512 . . . . 70.5 110.326 175.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.607 ' HB3' HG13 ' A' ' 27' ' ' ILE . 2.0 t30 -82.43 108.02 15.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.832 -0.803 . . . . 52.24 108.832 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.4 t -62.03 -25.61 67.76 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 113.028 0.751 . . . . 62.12 113.028 -171.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.436 ' HG2' HD22 ' A' ' 24' ' ' ASN . 1.5 pm0 -88.3 0.88 55.64 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.986 0.365 . . . . 72.42 111.986 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.607 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.1 mt -113.31 147.78 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.476 -0.564 . . . . 71.4 109.476 176.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -88.5 157.95 18.48 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.837 -0.431 . . . . 71.13 109.837 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.423 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 31.4 m -65.73 -27.54 68.39 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.107 0.48 . . . . 54.42 110.012 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.19 -29.94 76.4 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.63 -0.714 . . . . 73.51 112.669 178.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -69.96 -30.98 68.47 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.468 0.651 . . . . 72.11 109.612 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.7 t -82.1 -32.89 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.189 -0.914 . . . . 54.42 110.771 -177.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.402 ' HB3' ' CE1' ' B' ' 247' ' ' PHE . 93.2 p -65.92 -28.77 69.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.315 0.579 . . . . 65.11 109.803 176.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.0 -32.44 26.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.608 -0.724 . . . . 65.41 111.216 -178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.437 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 15.1 p -70.51 -36.79 73.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.971 0.415 . . . . 71.55 109.968 -178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.709 ' HD1' HD12 ' B' ' 214' ' ' LEU . 17.2 t80 -64.93 -35.29 80.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.402 0.62 . . . . 74.31 109.713 175.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.61 ' CG ' ' HB3' ' B' ' 273' ' ' TYR . 13.2 ttm -73.27 -47.44 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.657 -0.701 . . . . 74.32 111.529 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 14.9 t-105 -60.03 -36.63 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.919 0.39 . . . . 74.31 110.352 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.49 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.64 -38.09 88.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 73.51 110.862 177.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.0 tp -66.35 -38.48 87.71 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 110.012 -0.366 . . . . 51.02 110.012 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.473 ' HB2' ' HB2' ' B' ' 273' ' ' TYR . . . -60.74 -28.23 68.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.34 -0.391 . . . . 74.44 111.155 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -86.12 -45.44 11.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.037 0.446 . . . . 73.33 110.665 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.46 ' HD2' HG23 ' B' ' 215' ' ' ILE . 24.5 t80 -70.22 -37.16 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.898 -0.592 . . . . 65.4 111.205 -175.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.7 -18.6 58.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.289 -0.414 . . . . 74.32 111.184 -174.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.565 ' HB2' HD23 ' B' ' 277' ' ' LEU . . . -78.68 -5.15 52.3 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.109 0.48 . . . . 71.42 110.968 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -57.41 -39.51 76.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.42 109.913 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.424 ' HA ' HG22 ' A' ' 50' ' ' THR . 92.8 m-85 -75.91 -9.08 58.31 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.903 -0.59 . . . . 62.15 111.38 -176.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.504 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.13 -38.32 92.14 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.624 -0.99 . . . . 55.31 110.624 172.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.7 m -71.74 -6.81 44.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.494 0.318 . . . . 74.31 111.581 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.424 HG22 ' HA ' ' A' ' 47' ' ' PHE . 6.1 t -117.44 10.98 13.75 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.209 0.528 . . . . 74.32 110.113 178.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.73 -44.24 15.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.954 -0.566 . . . . 53.31 110.236 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.562 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.1 m-85 -145.29 176.35 9.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.426 -0.352 . . . . 61.4 111.081 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.4 ' HG2' ' H ' ' A' ' 53' ' ' GLU . 7.9 pt-20 -97.77 -42.29 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.712 -0.676 . . . . 62.22 111.636 -173.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 63.8 p -102.57 152.41 21.19 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.746 -0.207 . . . . 65.34 110.509 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -65.85 -32.19 73.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.083 0.468 . . . . 71.44 110.17 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -52.62 -51.32 60.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.043 -0.981 . . . . 63.02 110.606 178.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.628 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 20.9 mt-30 -87.65 -32.92 19.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.525 -0.761 . . . . 61.15 111.064 -176.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 18.5 ttt -64.21 -42.43 96.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.894 0.378 . . . . 64.34 110.786 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.55 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 36.7 tt0 -65.67 -27.7 68.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 75.21 110.679 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.99 -8.45 57.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.358 -0.383 . . . . 71.11 110.778 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.628 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 29.4 mmmt -114.87 -6.62 12.62 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.35 -0.386 . . . . 71.21 111.319 -176.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.703 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 56.5 pttt -65.23 -44.7 87.36 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.614 -0.435 . . . . 65.12 110.956 -172.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.42 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 9.1 tp60 -74.96 -16.99 60.62 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.921 -0.4 . . . . 73.14 109.921 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -78.82 -38.59 37.76 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.375 -0.375 . . . . 72.13 110.765 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.703 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 18.4 ptp -80.65 -27.92 37.02 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.633 -0.877 . . . . 71.35 108.633 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.423 ' CE ' ' HB3' ' B' ' 277' ' ' LEU . 45.5 mtp -90.45 9.6 28.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.994 -1.003 . . . . 64.3 111.248 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -81.36 -37.15 28.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.401 -0.592 . . . . 74.12 109.401 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.527 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 48.3 p90 -106.83 -10.1 16.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.607 -0.724 . . . . 63.34 111.327 -175.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.431 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 2.3 m-30 -55.55 -51.35 67.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.714 0.292 . . . . 74.33 110.992 -178.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.886 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.83 -41.27 77.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.704 0.764 . . . . 74.33 110.008 175.854 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -80.71 3.74 21.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.417 -1.265 . . . . 73.24 112.443 -169.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.692 ' HB2' ' SD ' ' B' ' 237' ' ' MET . 48.0 mtm180 -82.76 -41.53 19.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 121.653 -0.654 . . . . 73.33 110.621 -173.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.832 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -94.12 9.83 36.21 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.285 0.564 . . . . 64.11 109.924 -176.08 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.222 -0.899 . . . . 64.01 110.003 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -68.93 -30.26 68.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 75.5 110.844 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.411 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 57.1 mtt -68.26 -38.54 81.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.378 0.609 . . . . 75.5 110.064 176.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.598 ' HB3' ' HE3' ' B' ' 266' ' ' MET . 0.5 OUTLIER -72.14 -44.85 62.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.125 -0.943 . . . . 73.51 110.63 -176.531 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.63 -41.21 80.92 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.314 0.578 . . . . 61.22 110.213 -178.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.87 -20.12 65.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.078 -0.965 . . . . 71.3 111.753 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.682 ' OD1' ' HD2' ' B' ' 242' ' ' ARG . 0.8 OUTLIER -92.83 -30.35 15.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.781 0.324 . . . . 72.34 110.868 179.721 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.593 ' HE2' ' HA ' ' B' ' 245' ' ' ALA . 21.6 mmt -61.89 -61.96 2.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.776 -0.647 . . . . 74.34 111.226 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.58 ' HA ' HD12 ' A' ' 85' ' ' ILE . 7.4 pt-20 -70.22 -13.08 62.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.721 -0.672 . . . . 72.43 112.771 -171.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.1 -51.96 66.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.374 . . . . 64.32 110.303 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -64.95 -36.51 84.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.128 0.49 . . . . 73.33 110.0 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.888 HD13 ' HA ' ' B' ' 259' ' ' GLN . 79.3 mt -63.69 -57.16 12.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.382 -0.826 . . . . 72.52 112.136 -176.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.8 pt-20 -61.72 -32.48 72.71 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.037 -0.265 . . . . 63.45 111.084 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -93.2 5.24 52.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.342 -0.39 . . . . 65.15 111.592 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.541 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 63.7 t80 -57.36 -49.88 74.74 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 121.481 -0.088 . . . . 72.0 111.225 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.445 ' OD2' ' HD3' ' B' ' 255' ' ' LYS . 72.1 m-20 . . . . . 0 CA--C 1.519 -0.228 0 CA-C-O 120.985 0.421 . . . . 73.21 110.45 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.769 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 94.7 m-20 . . . . . 0 CA--C 1.519 -0.242 0 N-CA-C 110.281 -0.266 . . . . 75.12 110.281 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . 0.447 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 13.6 tp10 -132.43 -77.37 0.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.092 -0.504 . . . . 75.34 110.239 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -98.92 -21.74 16.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.402 0.62 . . . . 74.55 109.769 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.469 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -148.72 168.66 22.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.565 -0.743 . . . . 74.54 112.043 -174.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.769 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -70.87 53.81 0.16 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.488 -1.233 . . . . 73.24 112.429 178.295 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.447 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 29.3 m-85 -56.24 -47.4 78.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.611 -0.268 . . . . 72.43 111.136 -178.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.94 -16.05 63.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 63.0 111.735 -176.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.681 ' HA ' ' HE ' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -88.12 -63.59 1.28 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.44 -0.345 . . . . 53.12 110.16 177.673 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.624 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -53.67 -29.65 39.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.905 0.705 . . . . 72.12 112.905 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 7.1 t -64.68 -25.01 67.76 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.675 0.274 . . . . 45.1 111.073 -177.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -82.3 -24.3 34.73 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.251 0.548 . . . . 73.21 109.622 -178.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.709 HD12 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -68.9 -42.63 76.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.347 -0.842 . . . . 70.51 109.279 177.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.49 HG13 ' HB1' ' A' ' 39' ' ' ALA . 87.8 mt -68.91 -28.48 39.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.423 -0.808 . . . . 72.12 110.255 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' B' ' 212' ' ' THR . 28.4 mmmt -57.27 -47.26 81.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.349 -0.387 . . . . 64.23 111.503 178.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.509 HD13 ' O ' ' B' ' 217' ' ' LEU . 1.9 tm? -61.59 -32.17 72.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.5 -0.556 . . . . 74.12 109.5 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -68.8 -32.98 73.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.819 -0.628 . . . . 54.54 110.821 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -66.56 -31.05 71.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.877 0.37 . . . . 71.22 110.783 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.66 -4.81 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.08 -0.509 . . . . 64.11 111.175 -178.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -110.17 -17.86 13.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.529 0.68 . . . . 72.44 109.295 172.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -78.96 -21.54 47.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.871 -1.058 . . . . 75.42 110.196 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.17 12.37 0.74 Allowed 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.671 -0.695 . . . . 73.34 111.975 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.501 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.0 OUTLIER -98.31 109.35 22.12 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 44.32 109.72 179.599 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . 0.4 ' H ' HG22 ' B' ' 225' ' ' THR . 2.7 t -65.46 -28.89 69.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.488 0.551 . . . . 61.44 112.488 -173.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . 0.425 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.7 pm0 -87.91 4.58 44.23 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.915 0.339 . . . . 61.2 111.915 -179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.501 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.1 mt -117.86 161.66 16.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.149 -0.686 . . . . 52.22 109.149 174.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.744 HE21 ' N ' ' B' ' 228' ' ' GLN . 0.0 OUTLIER -105.29 152.23 23.16 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.477 -0.564 . . . . 74.53 109.477 178.554 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.0 m -55.83 -28.28 55.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.03 0.443 . . . . 72.15 110.687 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -64.11 -22.67 67.18 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.705 -0.679 . . . . 75.43 113.22 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -83.84 -17.13 41.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.232 0.539 . . . . 50.31 110.018 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 15.2 t -90.2 -39.52 12.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 72.42 109.854 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 33.5 p -65.8 -34.36 77.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.21 0.529 . . . . 63.34 109.841 175.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -72.03 -34.33 68.72 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.571 -0.741 . . . . 33.24 111.325 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.467 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 4.0 p -75.82 -32.64 59.92 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.986 -0.376 . . . . 34.33 109.986 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.47 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.9 t80 -64.96 -39.73 93.94 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.001 -0.74 . . . . 74.24 109.001 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.832 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 1.2 ttm -66.65 -48.3 69.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.395 -0.82 . . . . 62.14 111.226 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.451 ' HZ2' ' HE1' ' A' ' 8' ' ' TYR . 19.2 t-105 -60.62 -44.46 96.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.395 -0.366 . . . . 72.02 110.758 177.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.533 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -61.95 -36.26 80.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.412 . . . . 74.42 111.057 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.52 -40.56 97.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.378 -0.374 . . . . 71.1 110.278 177.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.584 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.77 -45.1 94.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.065 0.46 . . . . 72.45 110.344 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . 0.682 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 11.1 mmm180 -58.87 -41.28 86.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 63.31 110.755 178.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' B' ' 246' ' ' TRP . 10.5 t80 -75.92 -38.22 57.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 64.04 111.028 -175.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -69.55 -31.78 70.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.887 0.328 . . . . 64.41 111.887 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.593 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -72.32 -17.64 61.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 65.03 111.266 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . 0.404 ' HB3' ' O ' ' B' ' 243' ' ' TYR . 12.6 t90 -64.64 -23.69 67.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.614 -0.721 . . . . 74.2 109.68 175.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . 0.429 ' O ' HG22 ' B' ' 250' ' ' THR . 69.1 m-85 -85.47 2.89 42.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.095 -0.502 . . . . 74.24 111.39 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.87 92.44 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.237 -0.982 . . . . 61.51 111.445 175.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.0 m -62.33 -24.57 67.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.681 0.277 . . . . 71.54 111.658 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . 0.429 HG22 ' O ' ' B' ' 247' ' ' PHE . 14.6 t -98.27 10.7 40.05 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.606 -0.438 . . . . 44.14 110.738 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 33.7 t -87.93 -54.58 4.16 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.966 -0.383 . . . . 61.22 109.966 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.643 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 2.0 m-85 -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.165 0.507 . . . . 72.54 111.736 178.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.54 ' HG3' HG23 ' B' ' 254' ' ' THR . 8.9 pt-20 -95.45 -47.22 6.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.12 -0.946 . . . . 71.31 111.628 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.54 HG23 ' HG3' ' B' ' 253' ' ' GLU . 65.2 p -102.67 161.85 13.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.572 -0.285 . . . . 71.42 110.501 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.8 ptmt -72.38 -29.8 64.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.877 -0.329 . . . . 73.4 110.503 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -61.05 -41.7 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.938 -0.574 . . . . 50.33 110.574 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.616 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 23.3 mt-30 -86.81 -39.75 15.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.922 -0.581 . . . . 74.52 110.809 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.3 ttt -63.81 -35.8 81.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.404 -0.362 . . . . 73.11 111.194 -178.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.888 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.9 tt0 -62.52 -40.85 98.08 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.934 0.397 . . . . 74.23 111.073 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -71.35 -9.12 57.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.836 -0.62 . . . . 64.14 111.183 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.643 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 31.5 mmmt -107.99 -3.44 18.79 Favored 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 111.947 0.351 . . . . 53.21 111.947 -173.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 50.9 pttt -59.51 -49.73 76.65 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.217 -0.593 . . . . 74.32 110.401 -177.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . 0.504 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 17.8 tp60 -67.46 -23.19 65.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.873 0.368 . . . . 60.32 110.568 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -82.45 -34.24 28.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.192 -0.458 . . . . 73.44 111.535 -178.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 21.6 ptp -83.88 -25.34 30.31 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.883 -0.784 . . . . 71.42 108.883 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.598 ' HE3' ' HB3' ' A' ' 77' ' ' LEU . 56.1 mtp -85.83 -12.33 51.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.096 -0.956 . . . . 74.21 110.664 177.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -54.02 -41.35 67.92 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.099 -0.5 . . . . 53.21 111.087 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.573 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 17.9 p90 -105.89 -6.11 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.667 -0.697 . . . . 72.43 110.601 -175.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.486 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 1.4 m-30 -59.3 -54.06 51.13 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.641 -0.254 . . . . 75.4 110.477 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.886 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.98 -47.88 61.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.305 0.574 . . . . 65.01 110.207 174.492 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -86.05 23.68 1.46 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.113 -0.949 . . . . 71.15 112.272 -169.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 36.2 mtm180 -95.24 -28.84 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.382 -0.824 . . . . 71.15 111.576 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.61 ' HB3' ' CG ' ' A' ' 37' ' ' MET . 0.1 OUTLIER -112.2 13.04 20.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.175 0.512 . . . . 65.13 110.195 -178.689 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . 0.479 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 81.8 tttt -64.34 -51.98 60.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.648 -0.705 . . . . 72.53 110.843 -176.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.5 -30.75 68.68 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.926 0.393 . . . . 73.24 110.676 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.0 -39.77 93.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.759 -0.655 . . . . 54.11 110.13 177.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.565 HD23 ' HB2' ' A' ' 45' ' ' ALA . 0.5 OUTLIER -67.99 -40.03 83.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.481 -0.782 . . . . 64.21 110.57 -176.45 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.06 -34.87 78.51 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.025 0.44 . . . . 64.23 110.68 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.63 65.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 44.33 110.886 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -91.42 -29.28 17.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 74.44 110.124 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.577 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.9 mmt -61.54 -60.21 4.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 75.33 109.78 173.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.702 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 72.8 mm-40 -57.23 -22.6 42.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.595 -0.729 . . . . 71.51 111.926 -177.053 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -47.83 -50.37 26.33 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.436 0.46 . . . . 43.04 110.867 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -100.15 -10.61 21.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.369 -0.378 . . . . 75.2 111.729 178.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.702 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 68.1 mt -74.25 -55.25 12.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.726 -0.39 . . . . 65.43 110.503 177.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.665 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.1 pt-20 -66.18 -34.74 78.72 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.678 -0.409 . . . . 70.01 110.524 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.11 8.37 33.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.357 -0.383 . . . . 21.43 111.361 -178.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.85 -56.14 24.11 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.064 -0.347 . . . . 75.41 110.064 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 116.213 -0.449 . . . . 73.33 111.527 -179.87 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-O 120.79 0.328 . . . . 73.23 110.598 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -90.54 -71.84 0.6 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.206 -0.665 . . . . 55.14 109.206 172.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -129.67 -46.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 62.04 110.049 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.89 164.45 22.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.937 -0.574 . . . . 42.25 111.599 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.543 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.4 OUTLIER -80.36 43.17 0.62 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.572 -0.74 . . . . 73.33 112.009 -175.589 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -44.49 -58.81 2.76 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.103 0.409 . . . . 74.42 112.103 -173.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.6 -21.64 53.98 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.171 0.804 . . . . 40.11 113.171 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -75.94 -49.22 18.38 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.338 -0.226 . . . . 72.22 111.032 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.69 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -71.01 -17.48 62.63 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.729 0.776 . . . . 73.44 109.933 -174.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.4 m -57.26 -37.41 72.31 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 114.453 -1.249 . . . . 64.23 111.292 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HB2' HD11 ' B' ' 217' ' ' LEU . 27.3 mt-10 -81.27 -21.13 39.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 73.33 110.276 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -69.1 -41.99 76.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 73.35 109.402 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.491 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.0 mt -74.07 -23.48 18.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.963 -0.562 . . . . 60.34 110.238 175.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 21.2 mmmt -58.67 -41.3 85.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 70.43 111.335 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.6 tm? -66.8 -31.38 71.97 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.266 -0.642 . . . . 45.12 109.266 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 -33.23 72.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.43 -0.805 . . . . 71.43 110.231 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.657 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 95.1 m-20 -61.39 -42.41 98.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.652 -0.704 . . . . 52.52 110.494 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.44 -27.38 67.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.947 -0.569 . . . . 75.14 111.461 -177.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -82.65 -30.13 29.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.276 0.56 . . . . 64.33 109.916 176.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.441 ' ND2' HG23 ' A' ' 29' ' ' THR . 29.2 t-20 -73.8 -20.07 60.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.501 -0.772 . . . . 51.31 110.356 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 89.7 mt-30 -64.2 -16.48 62.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.103 -0.498 . . . . 70.41 111.059 179.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.464 HD22 HG13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -71.88 104.64 3.54 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.556 -0.535 . . . . 70.13 109.556 177.368 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -65.68 -34.53 78.43 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.46 -0.791 . . . . 60.02 111.912 -174.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -78.7 -5.78 54.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.325 0.491 . . . . 52.31 112.325 -176.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.464 HG13 HD22 ' A' ' 24' ' ' ASN . 7.2 mt -106.05 152.14 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.057 0.456 . . . . 63.24 110.222 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -79.35 155.96 28.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.76 -0.655 . . . . 74.34 109.68 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.441 HG23 ' ND2' ' A' ' 22' ' ' ASN . 8.1 m -69.84 -23.97 63.38 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.116 0.484 . . . . 72.11 110.431 -177.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.44 -14.62 74.72 Favored Glycine 0 C--N 1.333 0.396 0 CA-C-N 115.762 -0.654 . . . . 73.32 113.587 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -71.75 -37.92 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.416 0.608 . . . . 74.5 110.482 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 20.4 t -73.32 -43.03 57.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.598 -0.728 . . . . 74.15 110.695 -176.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.3 p -62.09 -44.11 97.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.085 0.469 . . . . 74.43 110.841 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.2 -32.92 74.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.812 -0.631 . . . . 60.45 111.14 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.7 m -65.89 -38.96 90.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.878 -0.416 . . . . 71.52 109.878 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . 0.717 ' HB3' HD13 ' B' ' 240' ' ' LEU . 1.2 t80 -67.12 -36.8 82.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.871 -0.604 . . . . 74.34 109.747 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.608 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.0 tpt -59.47 -53.76 54.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.157 -0.929 . . . . 54.55 110.473 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TRP . . . . . 0.469 ' NE1' ' HD2' ' A' ' 42' ' ' ARG . 18.1 t-105 -67.7 -38.7 84.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.943 -0.571 . . . . 75.44 111.42 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.47 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -62.4 -39.13 92.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.535 -0.302 . . . . 71.54 111.675 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.474 HD13 ' HB3' ' B' ' 236' ' ' PHE . 47.0 tp -65.44 -31.29 72.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.849 0.357 . . . . 75.53 110.574 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.18 90.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.248 -0.433 . . . . 74.45 110.918 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.469 ' HD2' ' NE1' ' A' ' 38' ' ' TRP . 28.8 mtp180 -68.84 -34.0 74.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 65.34 110.317 -177.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.434 ' HD2' HG23 ' B' ' 215' ' ' ILE . 6.0 t80 -76.64 -32.84 58.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.81 -0.632 . . . . 73.53 110.896 -175.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -79.21 -33.59 43.68 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.7 -0.227 . . . . 72.14 111.439 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.32 -17.93 64.97 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.189 0.518 . . . . 63.21 110.927 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -57.39 -32.32 66.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.193 -0.912 . . . . 74.32 111.062 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -85.05 1.68 46.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 61.13 111.969 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.59 -38.06 90.47 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.445 -0.883 . . . . 63.5 111.898 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.0 p -70.23 -17.9 63.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.85 0.357 . . . . 74.35 111.528 -177.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.2 p -92.44 -7.18 48.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 65.43 110.772 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -75.63 -35.96 60.35 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.229 -0.441 . . . . 52.35 111.677 -173.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.754 ' HE2' ' HG2' ' A' ' 61' ' ' LYS . 1.0 OUTLIER -147.27 175.67 10.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.329 0.585 . . . . 73.11 112.349 -175.8 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.629 ' HG3' HG23 ' A' ' 54' ' ' THR . 16.3 pt-20 -89.24 -37.08 15.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.08 -0.964 . . . . 73.03 111.546 -174.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.629 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.4 p -118.78 157.69 27.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 75.32 110.526 -177.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.475 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 21.2 ptmt -66.53 -29.95 70.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 73.54 110.503 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.34 -49.99 75.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.872 -0.604 . . . . 74.24 110.384 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.678 ' O ' ' HD3' ' A' ' 61' ' ' LYS . 21.8 mt-30 -78.08 -35.36 49.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.697 -0.683 . . . . 64.1 110.411 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 ttt -61.94 -41.29 97.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.049 0.452 . . . . 74.54 110.816 178.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.59 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.1 tt0 -65.47 -45.3 84.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.771 -0.65 . . . . 61.33 111.848 -176.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.36 -24.54 64.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.0 0.428 . . . . 64.33 111.355 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.754 ' HG2' ' HE2' ' A' ' 52' ' ' PHE . 3.9 mptp? -93.47 8.47 40.5 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 116.033 -0.531 . . . . 75.03 111.347 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.565 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 17.6 ptpt -51.7 -48.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.507 -0.553 . . . . 61.33 109.507 177.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.565 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 12.8 tp60 -72.22 -26.03 61.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.103 -0.498 . . . . 72.21 110.712 -176.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -81.84 -32.8 31.01 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 54.24 111.495 -176.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.8 ptp -83.36 -26.4 30.53 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 109.051 -0.722 . . . . 44.14 109.051 178.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.596 ' HG2' HD22 ' B' ' 277' ' ' LEU . 79.4 mtp -83.86 -4.68 58.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.16 -0.927 . . . . 64.3 111.756 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.59 -29.28 64.53 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.781 -0.822 . . . . 73.11 108.781 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 28.6 m-85 -99.93 -5.99 27.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.653 -1.158 . . . . 75.4 111.441 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.508 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 19.1 m-30 -77.3 -54.05 6.94 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.685 -1.228 . . . . 64.24 107.685 169.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.498 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -60.08 -66.27 0.55 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.308 -0.406 . . . . 71.54 110.21 171.313 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 10.6 t70 -95.44 82.62 3.7 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.437 0.532 . . . . 72.42 112.437 -171.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 8.8 mmm180 -153.15 -37.01 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.278 -0.419 . . . . 73.31 111.53 166.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.817 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -84.74 2.51 41.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 119.804 -0.758 . . . . 72.11 109.019 178.79 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.431 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 85.1 tttt -60.65 -50.55 73.05 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.039 -0.982 . . . . 65.1 110.079 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -37.19 85.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.255 -0.43 . . . . 75.05 111.113 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.5 mtt -63.01 -41.44 99.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.416 0.627 . . . . 74.4 109.919 177.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 1.3 tt -67.16 -43.06 83.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.815 -1.084 . . . . 73.01 109.86 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.84 -41.17 86.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.279 -0.873 . . . . 65.13 110.672 178.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.67 -10.36 59.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.413 -0.812 . . . . 70.24 111.987 -176.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.46 -3.17 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.783 -0.367 . . . . 72.5 111.463 -179.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . 0.437 ' HE3' ' CD2' ' A' ' 77' ' ' LEU . 23.8 mtt -88.16 -177.77 5.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.287 0.565 . . . . 61.34 111.752 177.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.772 ' HG2' HD12 ' A' ' 85' ' ' ILE . 34.1 mt-10 66.77 -3.75 0.87 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.634 -1.166 . . . . 71.03 112.879 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -56.45 -39.39 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.129 0.49 . . . . 71.31 110.405 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -92.71 -16.14 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.971 -0.559 . . . . 74.25 110.514 178.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.772 HD12 ' HG2' ' A' ' 82' ' ' GLU . 62.0 mt -79.1 -55.58 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 65.22 110.808 -175.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.609 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.0 pt-20 -64.64 -31.19 72.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.124 0.488 . . . . 55.54 110.268 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -89.12 7.72 33.66 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.827 -0.624 . . . . 52.55 111.382 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.412 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 70.0 t80 -62.24 -40.81 97.39 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.072 -0.344 . . . . 75.54 110.072 178.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 C--N 1.331 -0.22 0 N-CA-C 109.402 -0.592 . . . . 61.04 109.402 176.617 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 203' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 3.2 p-10 . . . . . 0 N--CA 1.452 -0.362 0 N-CA-C 108.57 -0.9 . . . . 74.34 108.57 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 204' ' ' GLU . . . . . 0.563 ' H ' ' HD2' ' B' ' 208' ' ' TYR . 38.4 tt0 -85.51 -83.48 0.17 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.848 0.356 . . . . 73.32 111.092 -178.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -116.18 0.11 12.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.401 0.62 . . . . 73.42 110.739 -177.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 206' ' ' ALA . . . . . 0.561 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -143.29 179.9 6.8 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.175 -0.466 . . . . 70.12 111.629 -174.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 207' ' ' PHE . . . . . 0.429 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.2 OUTLIER -73.51 43.91 0.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.218 -0.901 . . . . 71.23 112.139 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 208' ' ' TYR . . . . . 0.563 ' HD2' ' H ' ' B' ' 204' ' ' GLU . 59.0 m-85 -60.52 -26.04 66.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.08 0.466 . . . . 75.03 110.991 -178.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -74.48 -24.04 58.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 72.33 111.539 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 210' ' ' ARG . . . . . 0.429 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 25.1 mmt180 -89.34 -57.67 2.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.569 -0.287 . . . . 71.43 111.446 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 211' ' ' ALA . . . . . 0.592 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.55 -26.79 14.21 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.575 0.583 . . . . 60.41 112.575 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 212' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 7.3 t -69.58 -20.72 63.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.553 0.216 . . . . 43.13 111.024 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . 0.454 ' HB2' HD11 ' A' ' 17' ' ' LEU . 38.9 mt-10 -85.45 -30.56 23.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.065 -0.717 . . . . 75.53 109.065 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 214' ' ' LEU . . . . . 0.592 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.01 -50.1 67.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.216 -0.902 . . . . 75.31 109.962 177.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 215' ' ' ILE . . . . . 0.47 HG13 ' HB1' ' A' ' 39' ' ' ALA . 82.3 mt -65.32 -30.98 51.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.864 -0.607 . . . . 71.02 110.74 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 216' ' ' LYS . . . . . 0.409 ' HD2' ' O ' ' B' ' 216' ' ' LYS . 0.5 OUTLIER -61.51 -29.8 70.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.892 -0.594 . . . . 71.23 110.799 -176.762 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 217' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.5 tm? -72.01 -41.39 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.493 -0.558 . . . . 73.31 109.493 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.7 -39.11 79.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.755 -0.657 . . . . 73.24 111.262 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 219' ' ' ASN . . . . . 0.651 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.1 m-20 -61.89 -34.19 75.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 75.15 111.31 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -65.64 -34.26 77.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.918 0.389 . . . . 74.54 111.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -79.67 -26.7 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.139 0.495 . . . . 74.23 110.406 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -79.27 -9.65 59.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.621 -0.718 . . . . 74.21 110.417 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 223' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 87.2 mm-40 -73.95 -10.58 59.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.323 -0.399 . . . . 62.43 110.79 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 224' ' ' ASN . . . . . 0.745 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 3.7 t30 -70.68 112.34 6.84 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.833 -0.803 . . . . 63.01 108.833 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.7 t -47.85 -38.44 16.12 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 114.461 1.282 . . . . 63.33 114.461 -170.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -99.06 14.99 27.28 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.369 0.877 . . . . 60.01 113.369 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 227' ' ' ILE . . . . . 0.745 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 8.1 mm -96.7 154.21 3.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 O-C-N 121.472 -0.767 . . . . 43.4 110.062 177.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 228' ' ' GLN . . . . . 0.78 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 9.2 mt-30 -91.87 138.76 31.29 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.467 -0.938 . . . . 55.42 108.467 171.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 36.6 m -58.0 -27.63 63.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.151 0.5 . . . . 64.24 110.26 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -72.38 -11.6 76.22 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.512 -0.767 . . . . 74.22 113.631 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 231' ' ' GLU . . . . . 0.78 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 32.4 mt-10 -85.61 -27.54 25.39 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 117.886 0.843 . . . . 73.34 109.489 178.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.3 t -79.03 -39.48 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.356 -0.838 . . . . 70.34 110.175 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.6 p -61.08 -42.02 97.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.109 -0.496 . . . . 31.52 110.601 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.06 74.86 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.804 -0.635 . . . . 75.42 110.989 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 235' ' ' SER . . . . . 0.543 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 34.1 m -66.32 -37.45 85.41 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.867 0.365 . . . . 63.33 110.122 178.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 236' ' ' PHE . . . . . 0.661 ' CD1' HD12 ' A' ' 14' ' ' LEU . 9.6 t80 -64.6 -37.55 87.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.311 0.577 . . . . 72.22 109.463 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 237' ' ' MET . . . . . 0.817 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.4 ttm -66.39 -48.57 69.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.519 -0.764 . . . . 74.44 111.349 177.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 238' ' ' TRP . . . . . 0.485 ' O ' ' HG3' ' B' ' 242' ' ' ARG . 28.0 t-105 -62.14 -41.38 98.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.784 0.326 . . . . 74.51 110.981 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 239' ' ' ALA . . . . . 0.665 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -63.18 -39.29 94.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.84 0.353 . . . . 63.43 111.068 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 240' ' ' LEU . . . . . 0.717 HD13 ' HB3' ' A' ' 36' ' ' PHE . 42.5 tp -65.8 -36.12 82.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 72.53 110.503 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 241' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.1 -40.26 95.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.005 -0.543 . . . . 74.34 110.958 179.135 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 242' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' B' ' 238' ' ' TRP . 44.5 mtp180 -72.09 -37.27 69.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.221 -0.445 . . . . 70.14 110.073 -178.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -70.78 -40.93 72.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.803 -0.635 . . . . 63.04 111.013 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -69.28 -28.12 66.02 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.93 0.344 . . . . 63.35 111.93 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 245' ' ' ALA . . . . . 0.409 ' HB1' ' HG2' ' A' ' 81' ' ' MET . . . -68.82 -18.65 64.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.022 0.439 . . . . 64.43 111.324 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.8 t90 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.585 -0.734 . . . . 73.42 111.13 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -72.73 -5.77 40.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 64.53 112.457 -171.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 248' ' ' GLY . . . . . 0.553 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -58.88 -27.77 62.42 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.469 -0.872 . . . . 33.41 111.502 175.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 249' ' ' SER . . . . . 0.678 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 27.8 p -67.56 -21.2 65.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.558 -0.321 . . . . 75.14 111.426 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 26.5 p -91.12 -12.13 36.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.06 0.457 . . . . 74.44 111.039 -176.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 26.1 t -67.07 -42.53 84.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.659 . . . . 62.01 111.748 -172.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 252' ' ' PHE . . . . . 0.563 ' HD2' ' HG3' ' B' ' 261' ' ' LYS . 1.3 m-85 -150.61 -178.59 6.64 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.985 0.735 . . . . 74.12 112.985 -173.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 253' ' ' GLU . . . . . 0.514 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.5 pt-20 -93.13 -53.05 4.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.685 -1.143 . . . . 72.52 110.753 -176.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 254' ' ' THR . . . . . 0.514 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.0 p -100.84 158.57 15.88 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.086 -0.506 . . . . 73.02 110.505 -178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 255' ' ' LYS . . . . . 0.412 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.8 ptmt -68.36 -31.25 70.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.425 -0.352 . . . . 73.12 111.306 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.46 -45.51 93.44 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 54.1 110.673 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 257' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 18.4 mt-30 -80.49 -35.69 34.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 63.23 110.129 -179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 258' ' ' MET . . . . . 0.678 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.4 ttt -63.81 -44.89 91.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.512 -0.767 . . . . 61.53 111.447 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 259' ' ' GLN . . . . . 0.553 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.6 tt0 -61.3 -39.46 90.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.045 -0.525 . . . . 74.51 111.39 -178.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.68 63.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.158 -0.474 . . . . 74.24 111.328 -177.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 261' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' B' ' 252' ' ' PHE . 31.9 mmmt -97.51 -5.82 35.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.204 -0.453 . . . . 72.35 110.897 -176.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 262' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -52.67 -54.18 36.95 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.011 0.434 . . . . 71.3 110.477 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -68.02 -33.05 73.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.091 -0.504 . . . . 70.33 110.561 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.21 -40.38 78.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.72 -0.673 . . . . 74.24 111.763 -176.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 265' ' ' MET . . . . . 0.553 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 21.1 ptp -79.82 -25.61 40.77 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.488 0.661 . . . . 73.05 109.459 -177.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 266' ' ' MET . . . . . 0.43 ' HA ' ' CD2' ' B' ' 269' ' ' TYR . 44.5 mtp -78.32 -42.62 30.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.168 -0.924 . . . . 61.05 112.681 -176.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.61 -27.34 69.17 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.065 0.394 . . . . 64.23 112.065 -162.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 268' ' ' TYR . . . . . 0.579 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 30.2 p90 -94.15 -8.12 40.37 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.277 -0.569 . . . . 74.24 111.133 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 269' ' ' TYR . . . . . 0.43 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.5 m-30 -62.38 -49.69 74.54 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 110.004 -0.369 . . . . 74.44 110.004 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 270' ' ' MET . . . . . 0.469 ' O ' ' HG3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -53.54 -41.19 66.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.749 0.785 . . . . 63.01 109.427 175.314 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -86.75 8.85 20.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.516 -1.22 . . . . 74.33 111.66 -172.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 272' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 6.0 mmm-85 -84.09 -42.44 16.09 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 121.588 -0.695 . . . . 74.11 110.159 -174.245 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 273' ' ' TYR . . . . . 0.608 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.0 OUTLIER -99.61 14.94 28.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.698 -0.683 . . . . 71.12 110.318 -178.653 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -58.45 -58.67 7.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 75.41 109.64 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.2 -35.38 80.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.162 -0.927 . . . . 74.12 110.879 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.8 mtt -62.45 -42.43 99.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.857 -0.61 . . . . 70.31 110.285 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 277' ' ' LEU . . . . . 0.596 HD22 ' HG2' ' A' ' 66' ' ' MET . 1.6 tt -70.73 -38.9 73.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.208 -0.906 . . . . 54.45 110.088 -176.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -61.72 -35.37 77.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 71.25 110.048 175.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.54 -13.01 60.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.577 -0.738 . . . . 73.44 111.271 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -99.69 -9.25 23.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.571 0.701 . . . . 63.23 109.351 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 281' ' ' MET . . . . . 0.434 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.2 mmt -84.14 -170.07 2.9 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.85 -1.068 . . . . 65.44 109.786 174.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 282' ' ' GLU . . . . . 0.607 ' HA ' HD12 ' B' ' 285' ' ' ILE . 22.8 mt-10 72.09 -31.68 0.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.248 -0.887 . . . . 74.11 113.243 169.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -54.62 -54.79 36.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 45.43 110.954 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -68.4 -25.8 65.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.948 -0.569 . . . . 73.13 110.43 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 285' ' ' ILE . . . . . 0.607 HD12 ' HA ' ' B' ' 282' ' ' GLU . 54.6 mt -71.21 -56.24 11.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.18 -0.464 . . . . 60.21 110.76 -178.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 286' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -65.37 -27.91 68.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.063 0.458 . . . . 74.11 110.882 -178.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -94.53 10.3 35.18 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.431 -0.35 . . . . 72.34 111.497 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 288' ' ' PHE . . . . . 0.475 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 58.7 t80 -59.78 -48.81 80.2 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.18 -0.304 . . . . 74.41 110.18 177.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.331 -0.395 . . . . 72.35 110.936 177.817 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.7 t . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 110.013 -0.366 . . . . 75.25 110.013 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -79.51 -31.1 42.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.358 0.599 . . . . 72.41 109.691 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -122.05 139.94 53.1 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.436 -0.95 . . . . 65.24 108.436 174.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -82.3 -81.17 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.519 -0.472 . . . . 72.2 110.65 -177.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -120.4 -11.47 9.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.134 0.492 . . . . 74.24 110.977 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . . . -108.68 169.52 8.61 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.94 -0.573 . . . . 44.12 111.547 -177.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.81 41.98 0.76 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.614 -0.721 . . . . 75.31 111.737 -176.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 6' ' ' ALA . 75.3 m-85 -50.35 -49.91 52.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.388 -0.369 . . . . 74.44 111.645 -176.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.32 -44.11 88.5 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.921 -0.581 . . . . 61.42 111.819 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 34.6 mtm105 -72.46 -51.04 21.92 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.961 -0.296 . . . . 74.42 111.618 -176.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.627 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -60.5 -24.72 65.53 Favored 'General case' 0 CA--C 1.52 -0.195 0 CA-C-O 121.631 0.729 . . . . 61.34 110.796 -178.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -28.5 68.18 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.062 -0.972 . . . . 75.3 111.468 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.439 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.8 mt-10 -74.87 -29.21 60.95 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.37 0.605 . . . . 71.24 109.47 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -61.24 -45.94 92.47 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.872 -1.058 . . . . 64.24 109.694 177.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 65.1 mt -71.96 -27.06 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.713 -0.676 . . . . 71.41 110.276 177.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.478 ' HD2' HE22 ' A' ' 20' ' ' GLN . 0.0 OUTLIER -63.36 -31.94 73.23 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.063 -0.517 . . . . 61.11 110.431 -178.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.583 HD12 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -68.34 -40.12 81.68 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.15 -0.685 . . . . 71.32 109.15 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.14 -33.77 75.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.481 -0.781 . . . . 72.5 111.054 -178.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.556 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 11.5 m-80 -58.52 -40.78 83.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 74.25 110.785 179.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.478 HE22 ' HD2' ' A' ' 16' ' ' LYS . 2.9 mp0 -67.12 -34.83 78.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.85 -0.614 . . . . 73.33 111.655 -178.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -76.93 -28.01 55.08 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.902 0.382 . . . . 75.22 110.675 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.45 ' HB2' HG21 ' A' ' 32' ' ' VAL . 2.6 t-20 -83.81 -6.32 59.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.071 -0.513 . . . . 55.42 110.794 -178.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 46.2 mt-30 -69.97 -11.2 60.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.388 -0.369 . . . . 75.1 111.861 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.735 ' HB3' ' CG1' ' A' ' 27' ' ' ILE . 40.6 t30 -80.3 135.53 36.24 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.819 -0.437 . . . . 73.42 109.819 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -70.14 -40.58 74.71 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 113.197 0.814 . . . . 63.23 113.197 -170.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -87.43 1.33 53.72 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.433 0.531 . . . . 72.42 112.433 -174.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.735 ' CG1' ' HB3' ' A' ' 24' ' ' ASN . 13.2 mm -86.88 147.78 5.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.178 0.514 . . . . 61.21 109.658 178.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.763 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 2.2 mp0 -82.65 140.8 32.94 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 108.838 -0.801 . . . . 74.42 108.838 174.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.2 m -59.35 -28.18 66.6 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.147 -0.686 . . . . 73.21 109.147 175.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.526 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -74.09 -12.48 81.47 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.903 -1.044 . . . . 53.31 113.399 177.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.763 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 43.5 mt-10 -78.63 -35.56 45.33 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 118.079 0.94 . . . . 74.34 109.92 178.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.45 HG21 ' HB2' ' A' ' 22' ' ' ASN . 21.7 t -74.22 -40.86 51.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.732 -0.667 . . . . 72.42 110.605 -178.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 21.1 p -61.52 -44.14 97.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.063 0.458 . . . . 64.32 110.255 176.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.43 -31.03 71.91 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.659 -0.701 . . . . 73.22 110.982 178.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 63.4 m -67.89 -42.46 81.17 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 110.029 -0.36 . . . . 73.34 110.029 177.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.602 ' CD1' HD12 ' B' ' 214' ' ' LEU . 4.0 t80 -64.61 -33.72 76.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.698 0.761 . . . . 74.41 109.093 175.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.658 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.1 tpt -62.23 -60.08 4.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.646 -1.161 . . . . 64.21 110.935 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.445 ' CZ2' ' HD3' ' A' ' 42' ' ' ARG . 25.7 t-105 -59.36 -33.89 71.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.354 -0.839 . . . . 65.52 111.303 178.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.482 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.34 -42.99 95.97 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.232 -0.44 . . . . 55.34 110.991 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.588 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.3 tp -68.83 -34.09 74.91 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 110.024 -0.361 . . . . 64.02 110.024 178.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.64 -33.11 71.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.06 -0.518 . . . . 61.51 111.107 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.485 ' HG2' ' ND2' ' B' ' 280' ' ' ASN . 28.5 mtm180 -87.27 -45.59 10.47 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.387 -0.369 . . . . 64.42 111.061 178.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.517 ' HD2' HG23 ' B' ' 215' ' ' ILE . 18.5 t80 -68.18 -33.2 74.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.132 -0.485 . . . . 73.4 111.458 -173.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -86.49 -22.96 26.14 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.726 0.298 . . . . 73.31 111.6 -173.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.25 -10.4 59.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.45 0.643 . . . . 62.22 110.656 178.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 69.7 t90 -59.74 -24.9 64.41 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.014 -0.994 . . . . 72.05 111.57 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.403 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 75.3 m-85 -86.65 -0.53 56.41 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.039 0.385 . . . . 60.25 112.039 -176.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -65.12 -29.68 75.95 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 119.982 -1.104 . . . . 41.42 110.751 173.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.6 m -71.57 -5.45 33.41 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.254 -0.473 . . . . 64.45 111.825 -176.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -119.24 14.84 13.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.982 0.42 . . . . 71.23 111.15 178.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.95 -47.76 11.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 75.42 110.476 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.621 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 12.8 m-85 -142.47 165.07 28.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 116.121 -0.49 . . . . 65.24 110.145 179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.428 ' HG2' ' N ' ' A' ' 54' ' ' THR . 1.6 pm0 -82.12 -41.77 20.03 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.136 -0.938 . . . . 64.14 111.362 -171.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.428 ' N ' ' HG2' ' A' ' 53' ' ' GLU . 65.4 p -100.92 149.16 24.19 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.99 -0.55 . . . . 75.45 109.739 178.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.504 ' HB2' HG23 ' B' ' 285' ' ' ILE . 13.2 pttm -68.07 -25.13 65.2 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.57 -0.53 . . . . 72.14 109.57 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.5 mp0 -60.49 -49.77 76.22 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.536 -0.756 . . . . 52.1 110.574 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.54 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -81.08 -24.69 37.6 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.291 -0.413 . . . . 65.42 110.341 -178.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.497 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 11.7 ttt -71.8 -44.47 63.91 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.604 -0.725 . . . . 74.23 111.194 178.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.403 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 35.4 tt0 -62.68 -36.32 82.51 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.446 . . . . 74.12 111.371 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.01 -15.03 63.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.152 0.501 . . . . 73.43 111.313 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.621 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 32.0 mmmt -99.13 1.58 45.17 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.178 -0.465 . . . . 73.32 111.054 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 0.2 OUTLIER -52.37 -48.52 65.53 Favored 'General case' 0 C--N 1.326 -0.434 0 O-C-N 123.457 0.473 . . . . 70.41 110.469 -176.465 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.596 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 14.3 tp60 -72.3 -28.74 63.28 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.223 -0.444 . . . . 75.22 110.588 -175.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -78.17 -37.06 46.71 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.852 -0.613 . . . . 61.42 111.378 -176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 21.7 ptp -79.71 -26.12 40.95 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.092 -0.707 . . . . 62.11 109.092 -178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.53 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 88.7 mtp -81.23 -13.22 58.75 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.398 -0.819 . . . . 60.15 111.53 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -65.33 -26.96 68.27 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 122.115 0.96 . . . . 70.23 108.793 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -102.78 16.0 27.75 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.113 -1.403 . . . . 74.54 111.564 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.53 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.7 m-30 -106.83 -45.74 4.12 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.985 -0.746 . . . . 74.42 108.985 172.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -65.38 -60.66 2.73 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.983 0.421 . . . . 72.24 110.876 174.604 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -73.84 -16.6 61.13 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.34 1.237 . . . . 72.41 114.34 -168.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.0 mmm180 -96.92 3.04 52.29 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 113.641 0.978 . . . . 73.54 113.641 -158.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.582 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 7.42 11.51 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 115.652 -0.704 . . . . 72.21 109.203 167.623 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.439 ' O ' ' HE1' ' B' ' 266' ' ' MET . 2.6 pttm -78.78 -39.13 36.72 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.594 -0.73 . . . . 45.31 111.41 -172.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.544 ' CD ' ' H ' ' A' ' 75' ' ' GLU . 0.1 OUTLIER -70.23 -31.18 68.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 121.101 0.476 . . . . 70.33 110.04 -179.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.6 mtm -77.04 -27.97 54.67 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.68 -0.691 . . . . 62.03 110.038 176.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 6.8 tt -70.51 -46.86 62.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.011 -0.54 . . . . 61.45 109.778 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.436 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -60.34 -32.23 71.05 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.054 -0.521 . . . . 70.5 110.765 176.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.6 -15.31 62.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.919 -0.582 . . . . 64.41 111.48 179.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -104.9 -10.26 17.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.812 0.339 . . . . 75.21 110.537 177.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.44 ' O ' HG13 ' A' ' 85' ' ' ILE . 17.0 mmt -68.97 -48.36 63.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 74.15 110.511 177.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.551 ' O ' ' HG3' ' A' ' 86' ' ' GLU . 24.0 mm-40 -56.54 -30.28 62.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.686 -0.688 . . . . 73.2 111.743 -177.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -56.03 -25.76 46.04 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.039 0.447 . . . . 74.21 110.975 179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -107.69 -32.25 7.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.17 -0.468 . . . . 74.33 110.879 177.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 81' ' ' MET . 62.7 mt -70.61 -63.65 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 N-CA-C 111.932 0.345 . . . . 70.52 111.932 -176.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.728 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 0.9 OUTLIER -76.81 -3.26 37.47 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.045 0.45 . . . . 70.22 111.268 -174.525 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 23.6 m-80 -107.98 3.85 24.56 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.688 -0.687 . . . . 52.3 110.448 177.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -52.55 -52.84 52.95 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 116.293 -0.412 . . . . 74.4 110.936 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -58.13 -33.52 69.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.118 -0.492 . . . . 55.12 110.753 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -68.29 -51.82 40.6 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.167 -0.47 . . . . 74.14 110.414 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -64.97 -38.78 92.1 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.104 0.478 . . . . 72.31 110.598 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? -62.99 -24.16 67.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.423 -0.808 . . . . 72.14 109.63 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -90.66 -11.86 38.54 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.71 -0.677 . . . . 64.41 111.189 -178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 54.0 p -99.79 -2.32 35.4 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.475 -0.329 . . . . 62.42 111.463 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.458 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 3.3 pt20 -99.88 105.94 17.72 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 122.004 0.907 . . . . 75.33 111.199 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--N 1.313 -1.017 0 CA-C-N 114.552 -1.204 . . . . 65.12 110.122 177.818 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 50.1 m . . . . . 0 N--CA 1.456 -0.165 0 CA-C-O 121.112 0.482 . . . . 63.21 110.499 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -90.59 5.09 49.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.966 -0.561 . . . . 71.25 110.161 -179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 -156.05 145.36 20.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.664 -0.698 . . . . 64.02 109.439 179.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -81.45 -90.58 0.07 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.899 0.381 . . . . 60.14 110.894 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -106.11 -26.14 11.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.935 0.398 . . . . 54.14 110.679 -178.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.434 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -100.23 162.35 13.02 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.117 -0.492 . . . . 71.11 111.161 -178.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -75.9 43.83 0.28 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.42 -0.809 . . . . 72.1 112.602 -176.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.434 ' CE2' ' HB3' ' B' ' 206' ' ' ALA . 70.9 m-85 -54.17 -41.64 68.74 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.837 0.351 . . . . 73.13 111.321 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.7 -19.8 63.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.837 -0.62 . . . . 63.41 112.035 -176.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.412 HH12 HD12 ' A' ' 27' ' ' ILE . 49.2 mtm180 -92.9 -56.97 2.79 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.943 -0.303 . . . . 75.23 110.799 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.715 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -51.51 -27.37 10.47 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.539 0.57 . . . . 52.52 112.539 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.6 t -69.5 -20.95 63.71 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 121.058 -0.257 . . . . 60.43 111.363 -179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.406 ' HB2' HD11 ' A' ' 17' ' ' LEU . 49.8 mt-10 -81.12 -29.46 34.82 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.254 -0.647 . . . . 70.5 109.254 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.715 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.0 mm? -63.64 -46.54 85.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.975 -1.011 . . . . 72.03 108.96 175.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.517 HG23 ' HD2' ' A' ' 43' ' ' TYR . 74.6 mt -67.59 -32.66 57.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.404 -0.816 . . . . 73.54 110.253 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 2.1 tmmt? -60.39 -36.86 79.09 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.64 -0.709 . . . . 75.31 111.167 -179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.528 HD12 HD13 ' A' ' 14' ' ' LEU . 3.2 tm? -63.27 -41.18 99.0 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 108.787 -0.82 . . . . 72.43 108.787 177.243 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.11 -28.99 68.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.429 -0.805 . . . . 53.34 110.849 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 0.9 OUTLIER -64.35 -37.61 88.13 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.052 -0.522 . . . . 65.43 111.036 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . 0.403 HE22 ' HD2' ' B' ' 216' ' ' LYS . 2.8 mp0 -66.82 -39.95 87.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.361 -0.382 . . . . 62.41 111.196 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -76.84 -22.2 53.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.446 0.641 . . . . 75.02 109.945 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.34 -3.31 52.26 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.167 -0.924 . . . . 61.52 110.419 179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 52.0 mt-30 -78.93 -8.18 58.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.421 -0.354 . . . . 52.34 110.864 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.546 HD22 HG13 ' B' ' 227' ' ' ILE . 1.7 t30 -81.84 105.21 12.78 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.646 -0.501 . . . . 72.31 109.646 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.6 t -59.43 -32.34 70.11 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 113.305 0.854 . . . . 75.34 113.305 -171.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . 0.501 ' HG2' ' ND2' ' B' ' 224' ' ' ASN . 12.4 pt-20 -79.01 -12.4 60.03 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.795 -0.362 . . . . 74.11 111.068 -175.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.546 HG13 HD22 ' B' ' 224' ' ' ASN . 10.0 mt -97.82 150.0 4.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.104 0.478 . . . . 63.21 109.966 -177.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -85.87 150.7 24.34 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.814 -0.63 . . . . 71.21 109.752 176.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.3 m -57.53 -23.92 53.08 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.674 -0.694 . . . . 73.41 110.277 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.403 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.96 -25.62 75.44 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.348 -0.842 . . . . 55.04 113.692 -179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -76.64 -13.58 60.05 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-N 117.876 0.838 . . . . 73.34 110.392 -178.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 12.6 t -90.96 -42.06 13.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.705 -0.68 . . . . 50.24 109.858 178.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 25.2 p -63.96 -39.13 93.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.112 -0.494 . . . . 74.35 110.642 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.65 -33.1 74.88 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.124 -0.489 . . . . 60.14 110.693 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 38.7 m -67.68 -40.76 84.4 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.921 -0.4 . . . . 73.14 109.921 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.625 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.9 t80 -63.07 -35.63 80.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.539 0.685 . . . . 75.52 109.478 176.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.588 ' SD ' HD21 ' A' ' 40' ' ' LEU . 8.4 tpt -59.45 -60.74 3.38 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.796 -1.093 . . . . 75.23 110.808 178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.403 ' CZ2' ' HD3' ' B' ' 242' ' ' ARG . 25.3 t-105 -59.56 -36.26 75.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.228 -0.896 . . . . 74.54 111.532 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -64.41 -44.4 91.36 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.394 -0.366 . . . . 73.22 111.411 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.658 HD21 ' SD ' ' A' ' 37' ' ' MET . 43.5 tp -65.69 -33.94 77.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.941 0.4 . . . . 75.32 110.658 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.538 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.81 -43.6 97.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.95 -0.568 . . . . 32.24 110.924 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . 0.403 ' HD3' ' CZ2' ' B' ' 238' ' ' TRP . 68.6 mtm180 -70.95 -36.09 72.46 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.351 -0.386 . . . . 62.14 110.988 -179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -72.77 -39.17 66.98 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.336 -0.393 . . . . 65.33 110.725 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.4 m-20 -72.69 -32.08 65.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.395 -0.366 . . . . 54.44 111.98 -177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -67.45 -14.74 63.2 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.971 0.415 . . . . 72.23 111.371 -178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 80.2 t90 -60.56 -38.68 85.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.052 -0.522 . . . . 61.4 110.962 177.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.526 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 62.0 m-85 -68.6 -13.92 62.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.288 0.477 . . . . 74.32 112.288 -175.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -61.44 -33.81 86.05 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.419 -0.896 . . . . 35.53 111.767 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.626 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 70.1 p -65.92 -23.75 66.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.807 0.336 . . . . 71.1 111.756 -176.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 14.5 t -108.83 22.19 16.24 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.227 0.537 . . . . 75.14 110.444 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.4 t -87.13 -55.32 3.87 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.175 -0.466 . . . . 64.21 110.939 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.624 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -130.03 -179.65 5.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.083 0.468 . . . . 74.54 111.842 -177.313 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.417 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.2 pt-20 -89.87 -41.85 11.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.238 -0.892 . . . . 75.34 111.539 -173.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.417 HG23 ' HG3' ' B' ' 253' ' ' GLU . 81.9 p -117.31 151.92 35.97 Favored 'General case' 0 CA--C 1.509 -0.596 0 N-CA-C 110.026 -0.361 . . . . 75.25 110.026 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.728 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 12.7 ptmm? -65.77 -25.8 67.42 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.373 0.421 . . . . 70.22 110.441 -179.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -56.19 -54.58 43.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 73.33 110.217 176.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.643 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 16.3 mt-30 -79.43 -36.3 39.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.582 -0.735 . . . . 71.14 110.03 -178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.626 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 12.0 ttt -59.93 -46.79 88.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.488 -0.778 . . . . 62.12 111.577 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 33.5 tt0 -65.3 -30.27 71.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.953 0.406 . . . . 71.03 110.96 -177.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -77.55 -9.94 59.21 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.17 -0.468 . . . . 64.21 110.897 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.643 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.8 mmmt -104.14 -1.13 27.72 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 116.263 -0.426 . . . . 61.4 110.693 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' B' ' 259' ' ' GLN . 17.1 ptpt -57.5 -45.51 84.84 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.39 -0.368 . . . . 55.45 110.963 -174.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.507 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 12.2 tp60 -73.4 -19.56 60.96 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 121.058 -0.257 . . . . 75.21 110.924 -176.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -83.26 -33.95 25.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.412 -0.358 . . . . 74.21 110.908 178.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' B' ' 262' ' ' LYS . 22.6 ptp -79.93 -26.99 39.9 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 107.962 -1.125 . . . . 72.05 107.962 175.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.45 ' HG2' HD22 ' A' ' 77' ' ' LEU . 73.1 mtp -89.92 23.86 2.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 114.55 -1.205 . . . . 73.42 110.168 174.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -104.28 -29.43 10.79 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.13 -1.063 . . . . 65.44 108.13 167.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.419 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.6 m-85 -98.21 9.24 43.43 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.685 -1.143 . . . . 61.1 112.039 -177.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -94.71 -68.19 0.81 Allowed 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.543 -1.28 . . . . 74.14 107.543 166.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -51.3 -61.29 2.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.134 -0.939 . . . . 73.3 110.756 179.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -85.15 19.4 2.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.288 -0.869 . . . . 70.34 112.483 -166.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.419 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 17.6 mmm180 -121.72 -30.7 4.11 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 121.346 -0.846 . . . . 72.44 112.564 -175.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.47 ' HE2' ' HG ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -83.75 1.37 43.11 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 107.533 -1.284 . . . . 64.14 107.533 172.14 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.476 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 73.5 tttt -58.76 -58.26 9.37 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 112.929 -1.941 . . . . 71.42 111.279 178.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -32.51 74.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.222 -0.445 . . . . 63.35 111.284 -176.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 39.1 mtm -78.59 -21.97 47.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.203 0.525 . . . . 64.23 110.08 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.448 HD22 ' HG2' ' A' ' 66' ' ' MET . 5.6 tt -76.43 -47.14 24.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.665 -0.698 . . . . 62.01 110.004 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . 0.405 ' HB2' ' HE1' ' A' ' 66' ' ' MET . 36.1 t70 -67.15 -26.21 66.55 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.208 0.528 . . . . 63.54 110.416 178.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -60.65 -26.01 66.75 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.603 -0.726 . . . . 71.44 110.777 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . 0.485 ' ND2' ' HG2' ' A' ' 42' ' ' ARG . 35.7 m-80 -89.17 -30.04 18.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.305 -0.407 . . . . 63.24 110.244 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.623 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -56.08 -58.77 6.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 75.14 110.184 176.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.55 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 14.9 mm-40 -51.71 -37.33 50.44 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.612 -0.722 . . . . 75.45 112.081 -178.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -57.27 -52.37 65.6 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 123.255 0.347 . . . . 55.4 110.65 -179.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -70.42 -38.29 74.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.399 -0.364 . . . . 64.42 110.941 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.623 HG13 ' O ' ' B' ' 281' ' ' MET . 61.3 mt -59.9 -59.61 3.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 73.41 111.312 -177.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 5.9 pt-20 -60.0 -29.72 68.66 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.906 0.384 . . . . 65.11 111.204 -177.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -90.86 9.44 30.3 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.423 -0.353 . . . . 72.43 111.602 -177.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.46 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 39.1 t80 -60.49 -45.33 94.16 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.805 -0.443 . . . . 75.32 109.805 173.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -58.51 -20.61 47.46 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.929 -0.578 . . . . 74.14 110.616 176.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -89.56 -55.11 3.78 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.698 -0.683 . . . . 73.25 110.063 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -61.54 -38.31 86.96 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.335 -0.393 . . . . 73.54 111.976 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.504 ' NH2' ' HA ' ' B' ' 296' ' ' LYS . 5.1 tpm_? -65.44 -21.66 66.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.358 0.599 . . . . 74.33 110.378 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -92.14 -29.56 16.43 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.618 -0.719 . . . . 42.25 110.872 -175.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 24.1 p -83.54 -13.68 53.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.046 -0.525 . . . . 61.14 111.149 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -119.53 162.79 18.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.289 0.566 . . . . 72.01 111.217 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . 0.504 ' HA ' ' NH2' ' B' ' 292' ' ' ARG . 98.2 mttt . . . . . 0 C--O 1.25 1.107 0 CA-C-N 115.002 -0.999 . . . . 64.44 109.39 -179.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.476 0.855 0 CA-C-O 120.902 0.382 . . . . 64.54 110.745 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -78.54 -39.02 39.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.257 0.551 . . . . 44.51 110.308 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 6' ' ' ALA . 8.4 m120 -105.34 118.87 37.65 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.682 -0.69 . . . . 71.01 109.222 173.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -55.07 -73.09 0.06 Allowed 'General case' 0 C--N 1.33 -0.246 0 O-C-N 123.341 0.401 . . . . 65.11 111.402 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -133.22 -17.34 2.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.15 0.5 . . . . 74.21 110.694 177.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -107.48 163.27 13.2 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.96 -0.564 . . . . 51.42 111.674 -175.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.498 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.18 47.57 1.15 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.151 -0.931 . . . . 70.13 110.428 176.059 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 6' ' ' ALA . 73.2 m-85 -45.32 -52.09 10.21 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.032 -0.531 . . . . 74.45 111.492 -175.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.1 -34.93 74.16 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.708 -0.678 . . . . 55.52 111.972 -175.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -65.25 -54.05 35.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.374 -0.375 . . . . 74.41 110.497 -179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.69 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -74.19 -11.6 60.34 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.823 0.82 . . . . 65.25 110.265 -171.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.3 m -70.23 -28.15 65.03 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.522 -1.217 . . . . 64.14 110.292 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.454 ' HA ' ' HB2' ' A' ' 16' ' ' LYS . 9.3 mm-40 -82.66 -27.3 31.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.48 0.657 . . . . 73.45 109.758 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -65.23 -49.89 67.94 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.081 -0.963 . . . . 64.53 109.446 176.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.505 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.1 mt -65.15 -30.17 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-N 115.796 -0.638 . . . . 74.13 110.201 175.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.721 ' HD3' HE22 ' A' ' 20' ' ' GLN . 5.3 tmtt? -57.98 -45.87 86.07 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.477 -0.783 . . . . 74.04 110.504 -179.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.465 HD12 HD13 ' B' ' 214' ' ' LEU . 1.8 tm? -56.04 -45.33 79.23 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 109.675 -0.491 . . . . 52.2 109.675 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.64 -28.43 65.66 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.688 -0.687 . . . . 63.55 111.287 -179.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.626 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 23.4 m-80 -69.53 -26.89 64.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.269 -0.423 . . . . 71.22 111.374 -179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.721 HE22 ' HD3' ' A' ' 16' ' ' LYS . 2.6 mp0 -76.12 -30.54 58.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.246 0.546 . . . . 74.33 110.383 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -86.81 -16.98 34.57 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.89 -0.595 . . . . 64.24 110.007 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 22' ' ' ASN . 2.6 t-20 -84.57 -2.99 58.2 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.769 -0.65 . . . . 52.33 109.549 173.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.626 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 93.6 mt-30 -79.2 -2.16 39.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.807 -0.633 . . . . 74.03 109.718 173.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.594 HD22 HG13 ' A' ' 27' ' ' ILE . 2.3 t30 -74.84 106.85 6.57 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 108.1 -1.074 . . . . 54.0 108.1 172.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.2 t -53.53 -40.6 65.63 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 113.825 1.046 . . . . 62.23 113.825 -167.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -78.91 -21.01 47.98 Favored 'General case' 0 N--CA 1.462 0.146 0 N-CA-C 112.36 0.504 . . . . 74.23 112.36 -176.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.594 HG13 HD22 ' A' ' 24' ' ' ASN . 11.1 mt -84.87 144.57 9.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.171 0.51 . . . . 74.52 110.139 -176.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.563 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.9 OUTLIER -86.4 156.39 20.19 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.68 -0.691 . . . . 63.3 109.183 -179.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.1 m -60.62 -30.55 69.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.292 0.567 . . . . 74.01 109.785 177.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.477 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -81.95 1.9 85.25 Favored Glycine 0 N--CA 1.447 -0.605 0 CA-C-N 115.326 -0.852 . . . . 23.24 113.589 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.563 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 21.6 mm-40 -97.33 -19.46 18.5 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.85 0.825 . . . . 63.44 109.733 175.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.6 t -81.46 -25.92 10.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.739 -0.664 . . . . 72.12 110.169 -178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 p -59.9 -32.86 71.15 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.654 -0.703 . . . . 60.12 111.153 178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.27 -34.3 75.93 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.187 -0.461 . . . . 52.22 110.71 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 m -69.26 -37.53 77.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 74.13 109.896 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.577 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 6.7 t80 -68.95 -35.16 76.45 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.743 -0.662 . . . . 73.02 109.644 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.765 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 3.9 ttm -70.7 -46.68 62.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.74 -0.664 . . . . 51.43 111.455 179.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -60.1 -39.57 86.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.108 0.48 . . . . 74.14 110.331 176.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.58 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.24 -39.7 93.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.895 -0.593 . . . . 74.12 111.115 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.769 HD21 ' SD ' ' B' ' 237' ' ' MET . 44.0 tp -65.04 -34.8 79.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.4 -0.363 . . . . 71.14 110.475 178.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.99 -48.4 82.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.485 . . . . 65.34 110.75 177.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' HG2' ' OD1' ' B' ' 280' ' ' ASN . 20.7 mtm180 -68.81 -23.4 64.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.019 -0.537 . . . . 70.14 111.051 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.458 ' HD2' HG23 ' B' ' 215' ' ' ILE . 15.3 t80 -83.7 -31.35 26.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.258 -0.428 . . . . 72.42 110.735 -178.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -79.42 -26.01 41.94 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.786 0.326 . . . . 55.41 111.179 179.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.511 ' HB2' HD23 ' B' ' 277' ' ' LEU . . . -87.55 13.07 10.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.351 0.596 . . . . 42.44 110.784 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -76.81 -13.86 59.97 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.485 -0.779 . . . . 74.11 110.409 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -98.15 -86.87 0.34 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 109.429 -0.582 . . . . 74.42 109.429 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.67 -60.43 0.69 Allowed Glycine 0 C--N 1.333 0.361 0 O-C-N 123.357 0.411 . . . . 64.44 112.915 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.4 p -75.47 -1.6 24.87 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.221 0.534 . . . . 72.11 110.958 -176.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 p -65.84 -31.87 73.07 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.544 . . . . 52.34 111.392 175.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.0 m -74.22 -45.79 45.94 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.927 -0.579 . . . . 71.22 111.486 -178.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.518 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 15.9 m-85 -153.09 167.4 29.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.49 0.662 . . . . 52.54 112.106 -173.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.546 ' HG2' ' H ' ' A' ' 54' ' ' THR . 1.8 pm0 -91.18 -51.41 5.33 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.353 -1.294 . . . . 74.4 111.402 -175.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.546 ' H ' ' HG2' ' A' ' 53' ' ' GLU . 65.6 p -90.14 148.26 23.09 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 116.678 -0.237 . . . . 74.22 110.514 -178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.493 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 13.9 ptmm? -66.28 -26.21 67.23 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.337 -0.392 . . . . 62.22 110.478 -176.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 mp0 -57.39 -42.81 82.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.766 -0.652 . . . . 75.52 111.049 176.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 11.5 mt-30 -93.92 -35.57 12.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.969 -0.56 . . . . 63.31 110.039 -177.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.493 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 15.6 ttt -62.01 -47.88 82.8 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.364 -0.835 . . . . 74.51 111.449 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -63.81 -30.59 71.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.988 -0.551 . . . . 51.52 111.05 -176.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.88 -5.35 43.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.113 -0.494 . . . . 63.43 111.446 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.79 ' HE3' ' HG2' ' A' ' 64' ' ' GLU . 28.9 mmmt -116.04 5.36 13.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.448 -0.342 . . . . 70.15 110.201 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -57.58 -54.84 42.3 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.306 -0.406 . . . . 71.11 110.249 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.1 tp60 -68.64 -27.92 66.44 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.222 -0.445 . . . . 74.22 110.37 178.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.79 ' HG2' ' HE3' ' A' ' 61' ' ' LYS . 5.5 tp10 -65.23 -45.28 85.3 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 116.033 -0.531 . . . . 74.25 110.857 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.642 ' HA ' ' HE1' ' A' ' 68' ' ' TYR . 20.5 ptp -77.75 -26.28 49.79 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.402 0.62 . . . . 41.23 109.375 -177.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.467 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 65.6 mtp -80.94 -29.69 35.42 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.551 -0.75 . . . . 71.44 112.563 -177.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -64.22 -40.09 95.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.074 0.464 . . . . 75.33 110.725 -169.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.682 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 36.4 p90 -88.04 -12.15 45.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.931 -0.577 . . . . 71.24 110.493 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.474 ' O ' ' HE1' ' B' ' 237' ' ' MET . 2.3 m-30 -60.55 -44.7 95.83 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 121.229 -0.188 . . . . 71.53 110.623 178.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.687 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.55 -49.68 69.73 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 120.975 0.417 . . . . 61.32 110.05 173.679 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -85.19 47.91 1.49 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.605 0.717 . . . . 75.51 110.757 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.682 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 1.9 mmp_? -113.06 -23.07 10.23 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 121.705 -0.622 . . . . 73.21 111.158 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 1.035 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -118.89 9.1 11.86 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.621 -0.432 . . . . 65.11 110.983 177.605 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -64.05 -59.16 4.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.485 -0.325 . . . . 72.22 110.531 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -55.82 -37.83 69.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.849 0.357 . . . . 74.24 111.321 175.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 62.8 mtt -61.79 -42.11 98.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.484 0.659 . . . . 71.25 110.332 177.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.488 HD23 ' HB2' ' B' ' 245' ' ' ALA . 2.0 tt -69.18 -36.28 77.16 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.229 -0.896 . . . . 75.44 109.304 179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.483 ' N ' ' HE1' ' B' ' 266' ' ' MET . 12.1 t70 -61.45 -43.27 99.17 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.02 -0.991 . . . . 74.02 110.805 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -69.06 -14.28 62.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.514 -0.766 . . . . 73.54 111.814 -177.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -99.55 -4.98 29.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.82 0.343 . . . . 72.24 111.004 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.44 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 19.0 mmt -80.73 -178.76 6.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.334 0.588 . . . . 60.23 111.569 178.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.713 ' HG2' HD12 ' A' ' 85' ' ' ILE . 3.8 mt-10 67.64 -2.33 1.38 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.641 -1.163 . . . . 74.41 114.059 174.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -53.96 -53.99 45.17 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.031 0.443 . . . . 55.13 109.95 177.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -85.4 -9.52 57.44 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.94 -0.573 . . . . 63.15 111.255 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.713 HD12 ' HG2' ' A' ' 82' ' ' GLU . 61.6 mt -79.34 -62.2 1.47 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.889 0.376 . . . . 62.13 110.897 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.618 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -66.8 -24.08 66.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.346 -0.388 . . . . 74.54 110.72 -176.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.55 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . 47.8 m-80 -107.07 16.69 23.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.057 -0.52 . . . . 71.43 111.111 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.553 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 63.3 t80 -53.94 -49.41 68.75 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 111.556 0.206 . . . . 75.5 111.556 -177.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -54.77 -27.86 44.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.067 0.46 . . . . 64.01 111.273 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -82.44 -55.78 4.28 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.061 -0.518 . . . . 71.35 110.249 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.55 ' CE2' ' HB2' ' A' ' 87' ' ' ASN . 72.8 m-85 -60.05 -39.82 87.3 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.838 0.351 . . . . 64.3 111.739 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.489 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.4 tmm_? -64.32 -25.53 68.08 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.471 -0.566 . . . . 63.42 109.471 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -94.08 -33.09 13.5 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.477 -0.783 . . . . 73.42 111.349 -174.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 39.9 p -99.88 9.81 42.36 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.048 0.388 . . . . 74.43 112.048 -177.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -64.35 158.86 22.45 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.001 0.429 . . . . 63.42 110.697 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.1 mttm . . . . . 0 C--N 1.319 -0.72 0 CA-C-N 115.85 -0.613 . . . . 72.14 110.578 -172.899 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 C--O 1.231 0.091 0 CA-C-O 121.174 0.511 . . . . 33.42 110.279 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 42.5 m-80 -105.77 6.82 32.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.837 -0.619 . . . . 55.04 109.848 177.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.418 HD22 ' N ' ' B' ' 203' ' ' ASN . 0.9 OUTLIER -106.71 107.85 19.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.515 -0.766 . . . . 74.24 110.247 -178.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -96.35 100.28 11.9 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.18 -0.464 . . . . 74.55 110.794 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 70.9 25.22 3.9 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.748 0.785 . . . . 74.54 109.14 172.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -152.75 -176.24 5.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 74.45 111.904 -170.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -130.16 42.15 3.31 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.178 -0.919 . . . . 71.31 110.254 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -52.14 -41.05 62.21 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.642 -0.708 . . . . 74.52 111.843 -177.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.09 -20.7 64.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 71.04 111.431 -175.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 19.7 mmt180 -85.36 -65.2 1.04 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.287 -0.415 . . . . 71.44 110.091 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.627 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.82 -25.98 13.11 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 113.432 0.901 . . . . 70.42 113.432 -176.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.8 t -65.63 -28.04 68.82 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.632 0.253 . . . . 72.41 111.318 -177.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -82.7 -18.71 39.95 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.221 0.534 . . . . 65.11 110.251 -176.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.627 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -71.37 -46.19 61.01 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.566 -0.743 . . . . 72.5 109.461 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.58 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.8 mt -67.2 -30.79 50.47 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 CA-C-O 121.427 0.632 . . . . 72.55 109.905 175.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 10.5 tmtt? -57.55 -39.96 77.84 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.188 -0.914 . . . . 75.43 111.084 -177.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.461 HD12 HD22 ' A' ' 14' ' ' LEU . 2.8 tm? -63.66 -42.6 98.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.354 -0.385 . . . . 71.44 110.052 178.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.41 -33.2 72.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 43.55 111.402 -177.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -61.79 -32.73 73.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.304 -0.407 . . . . 72.21 111.109 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -74.14 -28.22 61.22 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.003 -0.544 . . . . 72.44 111.264 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -85.18 -21.18 29.28 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.923 0.392 . . . . 74.51 110.519 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -78.13 -1.97 35.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.469 0.652 . . . . 73.44 109.854 175.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -79.45 -4.43 51.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.877 -0.601 . . . . 54.52 109.944 175.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.475 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -69.93 103.52 2.26 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.955 -0.758 . . . . 44.42 108.955 175.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.9 t -59.86 -26.51 65.91 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 113.287 0.847 . . . . 73.51 113.287 -171.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . 0.475 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.6 pm0 -86.52 -5.05 59.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.226 0.454 . . . . 64.33 112.226 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.41 HG13 HD22 ' B' ' 224' ' ' ASN . 4.2 mt -115.97 150.47 17.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.931 0.395 . . . . 72.32 110.943 -177.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -88.76 166.35 14.1 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.094 -0.503 . . . . 74.1 109.783 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 10.4 m -67.22 -27.01 66.88 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.301 -0.409 . . . . 74.43 110.659 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -66.52 -27.44 73.16 Favored Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.938 -0.574 . . . . 61.25 113.322 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -74.4 -29.36 61.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.223 0.535 . . . . 73.34 109.778 179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.8 t -76.29 -26.23 16.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 70.45 109.695 178.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . 0.445 ' HA ' ' CE1' ' A' ' 43' ' ' TYR . 2.7 m -65.57 -24.68 67.15 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.819 -0.628 . . . . 75.42 109.75 174.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -85.51 -33.06 21.89 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.597 -0.729 . . . . 61.43 111.348 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.498 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 9.2 p -68.77 -34.36 75.44 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 120.7 -0.4 . . . . 61.21 110.41 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.64 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.3 t80 -67.18 -36.33 81.56 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.14 -0.689 . . . . 71.34 109.14 174.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 1.035 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.4 tpt -62.66 -57.5 10.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.142 -0.935 . . . . 64.12 110.554 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.498 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 31.1 t-105 -60.23 -35.62 75.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.455 -0.793 . . . . 73.21 111.643 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.504 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -62.65 -47.11 85.13 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.701 0.286 . . . . 71.4 110.945 178.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.562 HD13 ' HB3' ' A' ' 36' ' ' PHE . 40.0 tp -62.83 -28.21 69.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.311 -0.404 . . . . 72.12 110.872 178.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -66.09 -49.44 67.54 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.216 -0.447 . . . . 45.43 110.908 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.6 mtm180 -68.76 -23.7 64.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.319 -0.401 . . . . 53.51 110.862 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.505 ' HD2' HG23 ' A' ' 15' ' ' ILE . 13.7 t80 -78.9 -26.41 43.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.238 -0.437 . . . . 73.51 110.58 -179.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -90.61 -24.75 20.44 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.854 0.316 . . . . 72.53 111.854 -178.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.488 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -83.66 2.3 38.23 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.532 0.682 . . . . 60.54 110.285 176.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -76.3 -9.21 58.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.803 -1.09 . . . . 64.43 109.929 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.56 ' HB3' ' OG1' ' B' ' 250' ' ' THR . 80.2 m-85 -95.94 -89.07 0.26 Allowed 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.912 -0.773 . . . . 75.32 108.912 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . 64.63 -66.73 0.07 OUTLIER Glycine 0 C--N 1.334 0.437 0 O-C-N 123.663 0.602 . . . . 52.03 113.325 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 3.5 p -75.06 -3.34 31.99 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.107 0.48 . . . . 63.5 111.043 -175.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . 0.56 ' OG1' ' HB3' ' B' ' 247' ' ' PHE . 24.1 p -76.33 -11.71 59.95 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.948 -0.569 . . . . 75.3 111.038 176.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.2 t -86.4 -39.88 15.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.897 -0.592 . . . . 63.31 111.236 -177.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.55 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 4.0 m-85 -147.67 179.24 7.84 Favored 'General case' 0 C--O 1.231 0.129 0 N-CA-C 112.772 0.656 . . . . 75.22 112.772 -173.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.505 ' HG3' ' N ' ' B' ' 254' ' ' THR . 7.9 pt-20 -89.7 -50.98 5.75 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.035 -0.984 . . . . 64.05 111.334 -177.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.54 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 68.9 p -107.33 159.44 16.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.071 -0.513 . . . . 61.41 111.063 -173.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.553 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 20.2 ptmt -67.28 -32.07 72.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.471 -0.331 . . . . 74.51 110.814 -178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . 0.54 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.7 mp0 -57.56 -42.73 83.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.167 0.508 . . . . 74.44 110.46 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.488 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 14.1 mt-30 -89.7 -34.97 16.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.677 -0.692 . . . . 63.5 110.266 -177.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.404 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 14.8 ttt -63.5 -42.34 98.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.828 -0.624 . . . . 74.35 110.892 178.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.581 ' HG3' ' HE3' ' B' ' 262' ' ' LYS . 34.6 tt0 -62.64 -37.3 85.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.922 -0.581 . . . . 71.34 111.005 179.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.17 -9.0 50.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.091 -0.504 . . . . 52.42 111.159 -179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.55 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 30.9 mmmt -109.21 1.07 20.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.115 -0.493 . . . . 64.14 111.529 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.581 ' HE3' ' HG3' ' B' ' 259' ' ' GLN . 8.2 ptpp? -58.38 -39.74 80.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.711 0.291 . . . . 64.44 110.594 -175.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -90.1 -24.48 21.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 110.085 -0.339 . . . . 65.14 110.085 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . 0.415 ' HB2' ' HA ' ' B' ' 261' ' ' LYS . 45.8 mt-10 -75.17 -33.26 61.45 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.266 -0.424 . . . . 61.14 111.802 -179.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.2 ptp -77.87 -30.42 50.82 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 108.073 -1.084 . . . . 72.11 108.073 175.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.483 ' HE1' ' N ' ' A' ' 78' ' ' ASP . 45.2 mtp -87.33 16.47 5.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.981 -1.008 . . . . 70.03 110.703 177.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -91.79 -37.71 12.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.249 0.547 . . . . 54.01 110.072 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.512 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 13.9 p90 -109.06 -5.91 15.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.879 -0.6 . . . . 63.44 110.925 -178.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 3.9 m-30 -57.75 -48.01 80.86 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.634 0.254 . . . . 75.41 110.752 179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.687 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.71 -53.37 58.93 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.923 -0.581 . . . . 62.02 110.809 175.443 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -87.39 65.21 8.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.366 0.603 . . . . 74.42 111.444 -173.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.597 ' HB2' ' SD ' ' A' ' 37' ' ' MET . 85.2 mtm180 -125.63 -27.83 3.35 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.78 -0.645 . . . . 73.22 109.522 170.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.765 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -104.1 14.45 30.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.282 -0.417 . . . . 54.25 110.441 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -63.99 -58.76 5.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.065 -0.516 . . . . 75.25 109.828 179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -61.51 -36.03 79.38 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.455 . . . . 74.34 111.146 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 61.0 mtt -58.02 -46.77 84.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.316 0.579 . . . . 61.43 109.663 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.511 HD23 ' HB2' ' A' ' 45' ' ' ALA . 0.9 OUTLIER -67.02 -37.73 84.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.814 -1.085 . . . . 62.42 109.729 -177.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . 0.467 ' N ' ' HE1' ' A' ' 66' ' ' MET . 13.8 t70 -64.06 -37.95 89.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.499 -0.773 . . . . 75.12 110.092 179.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -72.37 -18.3 61.75 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.661 -0.7 . . . . 63.52 111.144 179.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . 0.444 ' OD1' ' HG2' ' A' ' 42' ' ' ARG . 14.5 m120 -89.64 -20.07 24.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.066 0.46 . . . . 72.24 109.798 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.46 ' C ' ' H ' ' B' ' 283' ' ' ASP . 24.3 mmt -73.67 -165.89 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.309 -0.859 . . . . 74.3 110.172 173.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.596 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 6.5 mm-40 66.48 -34.59 0.21 Allowed 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.339 1.056 . . . . 75.01 112.989 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . 0.46 ' H ' ' C ' ' B' ' 281' ' ' MET . 18.2 t70 -47.9 -60.07 2.87 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.436 0.694 . . . . 63.42 112.236 -177.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -80.55 -13.33 59.16 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.213 -0.449 . . . . 65.44 110.808 -177.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . . . . . . . . . 57.4 mt -78.79 -53.61 13.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 116.116 -0.493 . . . . 72.11 110.307 -179.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.596 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -63.15 -32.21 73.54 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.137 -0.483 . . . . 72.34 110.211 178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . 0.411 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 30.1 m-80 -90.49 11.96 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.792 -0.64 . . . . 75.31 111.922 -176.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 54' ' ' THR . 38.3 t80 -58.18 -43.4 87.5 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.86 -0.793 . . . . 74.42 108.86 172.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -54.7 -47.92 73.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.47 -0.786 . . . . 63.53 110.343 173.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -55.92 -59.29 5.1 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.923 -0.58 . . . . 74.33 111.006 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -70.49 -36.39 73.8 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.548 0.573 . . . . 64.23 112.548 -172.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 13.4 tpp180 -72.07 -21.16 61.56 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.776 -0.369 . . . . 72.1 110.206 179.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -86.36 -40.84 15.03 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.198 0.523 . . . . 72.01 110.289 178.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.0 p -98.46 29.17 3.75 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.604 -0.726 . . . . 74.24 110.135 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -60.41 161.7 7.08 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.762 -1.108 . . . . 71.33 112.615 -175.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 67.4 mttm . . . . . 0 C--O 1.248 0.977 0 CA-C-N 114.329 -1.305 . . . . 73.53 109.276 -178.009 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.477 0.89 0 N-CA-C 110.068 -0.345 . . . . 73.45 110.068 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -78.98 79.13 5.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.247 0.546 . . . . 63.34 110.351 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.491 ' HA ' ' HD2' ' A' ' 8' ' ' TYR . 4.6 p-10 -151.74 105.35 3.12 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.783 0.801 . . . . 72.34 109.209 174.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -84.22 -72.25 0.47 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.313 -0.858 . . . . 71.32 112.212 -169.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -89.46 -15.11 33.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.295 0.569 . . . . 55.21 110.712 -171.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . . . -139.13 167.11 22.8 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.944 -0.571 . . . . 75.23 111.615 -174.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.53 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -82.66 47.35 1.17 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.17 -0.923 . . . . 73.23 111.398 -179.171 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.491 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 68.7 m-85 -49.66 -42.22 44.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.378 . . . . 74.12 111.907 -176.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.18 -18.8 64.7 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.194 0.442 . . . . 73.51 112.194 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.2 mmt180 -83.62 -53.92 5.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.527 0.203 . . . . 73.51 111.06 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.752 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -66.74 -17.04 64.66 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.89 0.853 . . . . 45.03 109.932 -176.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -55.53 -35.93 66.19 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 114.03 -1.441 . . . . 74.44 111.535 175.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.658 ' HB2' HD11 ' B' ' 217' ' ' LEU . 25.6 mt-10 -83.68 -24.82 31.13 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.125 0.488 . . . . 74.5 110.126 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.752 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -67.12 -44.55 79.61 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.66 -0.7 . . . . 73.41 109.9 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 67.5 mt -73.48 -22.98 19.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.811 -0.631 . . . . 45.14 110.357 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -62.04 -34.98 77.25 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.889 -0.596 . . . . 70.44 110.622 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.561 HD12 HD13 ' B' ' 214' ' ' LEU . 2.5 tm? -72.71 -39.72 66.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.476 -0.564 . . . . 61.13 109.476 176.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.14 -42.86 95.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.222 0.534 . . . . 71.23 110.23 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.481 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 88.7 m-20 -65.26 -23.09 66.96 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.869 -0.605 . . . . 73.14 110.908 177.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -74.1 -35.8 64.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.102 0.477 . . . . 42.12 110.149 179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -81.23 -23.57 37.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.267 0.556 . . . . 54.13 110.137 178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -81.63 9.37 7.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.495 0.664 . . . . 73.13 110.201 178.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.481 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 26.5 mt-30 -83.81 -5.99 59.33 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.944 -0.571 . . . . 74.32 110.34 175.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.504 HD22 HG13 ' A' ' 27' ' ' ILE . 1.1 t30 -78.36 109.81 12.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 108.941 -0.762 . . . . 62.4 108.941 175.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 25' ' ' THR . 3.7 t -65.35 -30.2 71.02 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.916 0.71 . . . . 52.23 112.916 -170.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -86.12 -11.73 51.86 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.761 0.652 . . . . 72.04 112.761 -177.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.504 HG13 HD22 ' A' ' 24' ' ' ASN . 11.0 mt -96.05 144.97 9.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.38 0.61 . . . . 70.42 110.401 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.524 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -79.7 153.64 29.15 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.272 -0.876 . . . . 75.45 109.703 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.4 m -62.63 -20.88 65.22 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.965 -0.561 . . . . 65.24 111.212 -177.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -70.72 -27.11 72.93 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.903 -0.59 . . . . 63.03 113.73 -177.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 12.0 mm-40 -75.35 -18.96 59.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 117.525 0.663 . . . . 63.13 110.262 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -86.46 -43.35 16.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.66 -0.7 . . . . 64.44 110.249 178.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.408 ' HB3' ' CD1' ' B' ' 243' ' ' TYR . 10.7 p -61.59 -39.26 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.111 -0.495 . . . . 62.22 110.519 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.67 -33.06 75.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.912 -0.585 . . . . 45.14 111.11 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.3 m -69.49 -35.77 75.88 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.905 0.383 . . . . 43.23 110.059 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.512 ' CD1' HD12 ' B' ' 214' ' ' LEU . 8.1 t80 -67.9 -34.65 77.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.32 0.581 . . . . 74.23 109.509 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.806 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 13.0 ttm -67.0 -51.24 57.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.465 -0.789 . . . . 74.42 111.54 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 30.1 t-105 -60.65 -37.1 80.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.851 0.357 . . . . 73.23 110.584 178.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.56 -37.35 86.45 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.151 -0.477 . . . . 74.51 111.278 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.52 HD13 ' HB3' ' B' ' 236' ' ' PHE . 47.3 tp -70.01 -32.51 70.72 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.05 0.452 . . . . 61.01 110.22 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.522 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.45 -42.05 98.17 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.663 -0.699 . . . . 73.15 110.845 178.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 42' ' ' ARG . 39.5 mtp180 -69.94 -37.31 75.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.096 0.474 . . . . 75.45 110.558 179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -74.54 -34.81 63.06 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.789 -0.641 . . . . 62.22 111.405 -173.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 30.7 m-20 -74.61 -28.82 61.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.644 0.259 . . . . 54.11 111.495 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.6 -19.25 63.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.554 . . . . 62.11 111.055 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -61.9 -27.88 69.12 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.128 -0.942 . . . . 73.25 110.738 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.476 ' O ' HG22 ' A' ' 50' ' ' THR . 60.0 m-85 -90.41 10.36 25.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.367 -0.379 . . . . 70.32 111.718 -176.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.508 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.41 -27.16 73.5 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 120.416 -0.897 . . . . 71.22 111.423 176.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.776 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 26.1 p -67.57 -27.97 67.39 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 71.12 111.313 -177.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.3 t -90.89 12.83 18.25 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.152 0.501 . . . . 52.21 110.729 -176.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 48.1 t -78.99 -65.64 0.97 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 116.248 -0.433 . . . . 65.1 111.534 177.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.729 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 5.8 m-85 -133.02 -176.05 3.99 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 112.559 0.578 . . . . 71.33 112.559 -172.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.1 pt-20 -92.62 -48.69 6.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.065 -0.97 . . . . 63.01 111.415 -172.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.487 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.3 p -105.25 156.59 17.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.244 -0.435 . . . . 60.15 110.065 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.515 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.8 ptmm? -70.52 -25.28 63.05 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.837 -0.345 . . . . 75.25 110.882 -175.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -72.05 -42.21 66.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.084 -0.246 . . . . 71.02 110.917 -178.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.763 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.6 mt-30 -74.15 -45.15 50.53 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.637 -0.505 . . . . 73.04 109.637 176.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.776 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 17.2 ttt -57.88 -40.68 80.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 72.12 111.684 -179.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.541 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.5 tt0 -63.53 -36.59 84.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.95 0.405 . . . . 72.11 111.14 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.42 6.77 9.37 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.127 -0.488 . . . . 72.45 111.12 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.763 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 71.5 mmtt -115.21 -1.99 12.82 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-N 116.223 -0.444 . . . . 73.0 110.241 -177.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.478 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.2 ptmt -54.38 -56.5 18.01 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.431 -0.804 . . . . 62.24 110.393 -178.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.478 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.0 tp60 -70.25 -23.17 62.85 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 116.775 -0.193 . . . . 64.0 110.627 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -71.17 -41.48 70.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.44 -0.345 . . . . 62.02 110.612 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.508 ' SD ' ' HA2' ' A' ' 48' ' ' GLY . 20.2 ptp -81.96 -25.44 34.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 121.487 0.661 . . . . 71.3 109.309 -179.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.486 ' HG2' HD22 ' B' ' 277' ' ' LEU . 69.3 mtp -82.03 -25.25 34.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.426 -0.806 . . . . 75.14 111.785 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 23.9 t70 -64.23 -33.09 75.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.965 0.412 . . . . 74.32 110.582 -169.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -98.01 -14.28 20.64 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 116.021 -0.536 . . . . 74.4 110.548 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.439 ' HB2' ' HA ' ' A' ' 66' ' ' MET . 1.0 OUTLIER -57.66 -53.3 59.73 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 110.08 -0.341 . . . . 65.53 110.08 174.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.783 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -46.98 -58.53 3.87 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.615 -0.72 . . . . 73.43 110.879 174.877 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.595 ' OD1' ' HG2' ' B' ' 270' ' ' MET . 5.7 t0 -91.96 28.44 1.84 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.867 -0.606 . . . . 73.32 111.605 -169.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.446 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 4.6 mtp180 -84.45 -42.39 15.67 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.043 0.449 . . . . 63.33 110.555 -179.158 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.75 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.0 OUTLIER -87.78 19.58 3.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.258 0.551 . . . . 73.55 109.686 -178.445 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 25.2 tttp -57.11 -66.0 0.53 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.039 -0.982 . . . . 74.31 110.732 -178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -64.41 -27.23 68.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.949 -0.569 . . . . 64.21 110.949 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.4 mtt -66.3 -38.02 86.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.484 0.659 . . . . 72.41 110.067 176.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.57 HD22 ' HG2' ' B' ' 266' ' ' MET . 5.4 tt -76.83 -37.37 55.79 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.246 -0.888 . . . . 73.21 109.811 -178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.623 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 13.2 t70 -59.55 -41.19 89.56 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.962 -0.563 . . . . 74.41 110.421 178.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -71.24 -5.63 33.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.287 -0.87 . . . . 64.21 111.83 -177.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -105.67 -4.44 21.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.954 -0.298 . . . . 75.11 111.205 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 51.7 mtt -95.86 -172.87 2.69 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.842 0.353 . . . . 74.12 110.839 175.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.697 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 36.3 mt-10 67.12 -6.5 0.58 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.021 0.928 . . . . 74.33 113.466 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.56 -54.91 38.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.74 0.305 . . . . 51.42 110.783 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -9.12 49.03 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 120.959 0.409 . . . . 61.31 110.179 179.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.697 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -70.43 -57.03 8.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.869 0.366 . . . . 43.15 110.077 176.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.3 pt-20 -68.45 -17.95 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 73.44 110.733 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -109.32 14.56 23.66 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.084 -0.507 . . . . 60.53 111.487 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -58.68 -51.82 68.32 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.73 0.3 . . . . 74.51 110.296 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -61.75 -36.48 81.14 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.097 -0.501 . . . . 71.53 110.273 178.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -60.24 -56.37 22.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.708 -0.678 . . . . 72.04 110.514 177.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -62.61 -47.82 82.09 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.441 -0.345 . . . . 71.3 111.207 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 92' ' ' ARG . 0.1 OUTLIER -60.2 -20.87 60.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.896 -0.593 . . . . 71.32 110.948 -178.136 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -88.25 -31.12 19.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.107 -0.497 . . . . 64.5 110.844 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 24.9 p -82.62 -26.1 32.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.166 -0.47 . . . . 74.53 111.376 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -88.95 156.75 18.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.879 0.371 . . . . 73.13 110.231 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.432 ' HD2' ' N ' ' A' ' 96' ' ' LYS . 6.2 mptt . . . . . 0 C--N 1.321 -0.671 0 CA-C-N 116.129 -0.487 . . . . 65.5 110.434 -174.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.232 0.138 0 CA-C-O 121.205 0.526 . . . . 62.03 110.641 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -154.8 103.32 2.42 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.719 -0.673 . . . . 45.1 109.779 178.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -169.68 148.49 3.66 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.71 -0.478 . . . . 74.12 109.71 -178.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -78.34 -81.34 0.1 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.57 -0.286 . . . . 74.31 110.479 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -112.23 -47.06 3.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.896 0.379 . . . . 70.2 110.623 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -80.26 155.84 27.12 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.031 0.443 . . . . 64.35 111.402 -179.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.11 51.93 0.7 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.379 -0.828 . . . . 60.1 112.602 -176.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -56.99 -32.96 66.63 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.976 0.362 . . . . 62.4 111.976 -177.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -81.1 -7.72 59.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.888 0.329 . . . . 62.2 111.888 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 88.0 mtt180 -94.1 -62.5 1.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.371 -0.233 . . . . 71.51 110.371 178.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.725 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.75 -26.34 13.86 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.844 0.683 . . . . 60.13 112.844 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.01 -18.5 65.41 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 121.187 -0.205 . . . . 71.21 111.534 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.51 -25.61 22.47 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.296 0.569 . . . . 52.33 109.573 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.725 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.64 -47.32 69.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.276 -0.875 . . . . 73.21 109.475 176.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.456 HG13 ' HB1' ' A' ' 39' ' ' ALA . 71.1 mt -66.56 -29.96 48.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 115.47 -0.786 . . . . 71.51 110.667 178.154 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -59.14 -36.51 75.36 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.925 -0.58 . . . . 74.1 110.758 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.658 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.5 tm? -68.65 -43.75 75.59 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.432 -0.581 . . . . 70.34 109.432 178.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . 0.404 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -60.2 -40.9 91.7 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.026 -0.534 . . . . 42.53 110.613 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.577 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 84.8 m-20 -60.36 -30.85 69.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 71.32 111.199 178.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -30.05 62.84 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.811 0.338 . . . . 73.01 111.18 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -84.26 -24.33 29.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.584 0.707 . . . . 73.55 109.804 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.63 -9.47 58.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.881 -1.054 . . . . 72.41 110.127 177.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.577 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 25.4 mt-30 -76.99 -6.96 54.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.729 -0.669 . . . . 72.23 111.252 -179.614 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.584 HD22 HG13 ' B' ' 227' ' ' ILE . 1.6 t30 -72.77 111.86 8.29 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.603 -0.517 . . . . 64.41 109.603 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . 0.434 ' H ' HG22 ' B' ' 225' ' ' THR . 1.8 t -61.78 -35.51 78.36 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 113.142 0.793 . . . . 71.21 113.142 -171.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.57 -1.22 57.79 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.589 0.589 . . . . 73.22 112.589 -176.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.584 HG13 HD22 ' B' ' 224' ' ' ASN . 7.0 mt -107.69 153.19 9.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 C-N-CA 120.621 -0.432 . . . . 61.15 110.125 178.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.685 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 10.4 pt20 -91.99 159.04 15.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.592 -0.521 . . . . 63.4 109.592 177.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 1.1 m -59.67 -26.56 65.64 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.253 -0.43 . . . . 64.32 111.141 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -65.84 -26.36 72.15 Favored Glycine 0 N--CA 1.451 -0.322 0 CA-C-N 115.629 -0.714 . . . . 62.51 113.695 -176.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.685 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 5.7 mm-40 -78.8 -24.53 44.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.387 0.593 . . . . 71.24 109.615 -178.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . 0.404 HG11 ' O ' ' B' ' 218' ' ' ALA . 26.3 t -82.24 -41.84 18.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.44 -0.8 . . . . 63.43 110.092 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 13.3 p -62.3 -37.35 85.23 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.112 -0.494 . . . . 72.33 110.121 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -34.04 76.63 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.889 -0.596 . . . . 74.45 110.882 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 42.3 m -68.41 -35.65 77.97 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 120.855 0.359 . . . . 63.14 110.045 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.578 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.55 -38.01 83.51 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.294 -0.632 . . . . 75.04 109.294 176.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.75 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -62.13 -53.05 60.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.097 -0.956 . . . . 74.21 110.948 176.919 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -61.81 -38.67 89.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.125 -0.489 . . . . 74.11 111.114 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.653 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.37 -41.34 96.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.376 -0.374 . . . . 70.14 111.423 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 59.6 tp -64.98 -34.39 78.31 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-O 120.666 0.27 . . . . 75.11 110.371 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.48 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -62.47 -39.14 92.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.367 -0.379 . . . . 74.21 111.104 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 22.3 mtp180 -73.3 -34.94 66.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.146 0.498 . . . . 65.13 110.339 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.408 ' CD1' ' HB3' ' A' ' 33' ' ' SER . 4.3 t80 -80.94 -30.4 35.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.604 -0.725 . . . . 74.35 110.585 -175.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -77.46 -40.59 42.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.404 -0.362 . . . . 72.12 110.824 -178.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -62.35 -17.82 59.9 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.098 0.475 . . . . 72.52 111.274 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 66.9 t90 -59.32 -26.87 65.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.284 -0.871 . . . . 75.33 111.307 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.429 ' O ' HG22 ' B' ' 250' ' ' THR . 67.4 m-85 -89.6 1.36 56.09 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.373 -0.376 . . . . 72.22 111.511 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -63.72 -29.47 74.83 Favored Glycine 0 N--CA 1.445 -0.745 0 C-N-CA 120.067 -1.063 . . . . 72.31 111.144 175.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 22.5 m -71.15 -6.97 43.44 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.102 0.408 . . . . 73.41 112.102 -177.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . 0.429 HG22 ' O ' ' B' ' 247' ' ' PHE . 12.8 t -115.6 16.99 16.46 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.0 0.429 . . . . 43.14 110.623 176.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 23.2 t -83.97 -59.16 2.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.346 -0.388 . . . . 62.3 110.876 179.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.723 ' CE2' ' HG2' ' B' ' 261' ' ' LYS . 1.6 m-85 -126.96 172.97 9.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.618 0.247 . . . . 71.52 111.006 -179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.408 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 7.8 pt-20 -94.1 -42.55 8.94 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.053 -0.522 . . . . 65.11 111.727 -173.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 50.7 p -100.16 154.12 18.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.508 -0.315 . . . . 71.54 110.39 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -65.1 -30.75 71.71 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.9 -0.32 . . . . 71.14 110.595 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -66.85 -45.93 76.64 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.014 0.435 . . . . 73.41 110.88 -178.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.568 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 22.8 mt-30 -80.19 -24.77 40.08 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 116.147 -0.479 . . . . 73.41 110.768 -178.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.483 ' SD ' HG12 ' A' ' 85' ' ' ILE . 20.3 ttt -76.34 -39.24 54.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.063 0.459 . . . . 70.15 110.214 176.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.554 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.0 tt0 -67.8 -49.01 64.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.857 -0.611 . . . . 71.41 111.651 -177.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -66.49 -23.26 66.23 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.128 0.49 . . . . 74.31 110.641 -176.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.723 ' HG2' ' CE2' ' B' ' 252' ' ' PHE . 13.6 mptt -95.89 8.67 42.98 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.47 -0.787 . . . . 33.55 111.487 -175.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.629 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 15.2 ptpt -52.82 -45.74 67.43 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.309 -0.626 . . . . 74.54 109.309 175.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.629 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 10.2 tp60 -75.0 -24.07 58.34 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.99 -0.55 . . . . 72.53 110.858 -175.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.25 -46.31 74.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.571 0.224 . . . . 74.34 110.936 178.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.51 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.7 ptt? -78.4 -33.21 48.9 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 120.279 -0.568 . . . . 64.2 109.736 177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.623 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 45.8 mtp -83.13 21.65 1.06 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.796 -0.638 . . . . 64.04 111.0 177.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . 0.498 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 34.7 t70 -109.45 -25.08 10.69 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.659 -0.497 . . . . 62.13 109.659 174.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.488 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 18.3 p90 -113.81 -20.62 11.05 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 120.423 -0.511 . . . . 70.14 111.651 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -54.63 -48.24 72.5 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.097 0.475 . . . . 73.25 110.388 177.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.595 ' HG2' ' OD1' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -53.88 -47.67 70.84 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.238 -0.892 . . . . 65.42 110.584 175.568 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . 0.482 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 5.4 t70 -78.89 7.11 7.68 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 114.485 -1.234 . . . . 74.55 111.801 -170.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 6.9 mtp180 -84.02 -26.42 29.14 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.918 -0.489 . . . . 71.25 111.669 -171.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.806 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -106.9 15.07 25.84 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 120.707 -0.397 . . . . 73.1 110.258 179.15 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.446 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 26.3 ttmt -60.78 -53.82 52.67 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.96 -0.563 . . . . 75.21 110.71 -179.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -64.31 -36.4 84.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.966 0.412 . . . . 61.25 110.801 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.4 mtt -58.91 -43.75 91.12 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 74.32 110.031 177.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 1.3 tt -72.4 -39.1 68.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.303 -0.862 . . . . 71.23 109.753 -178.093 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . 0.434 ' N ' ' HE1' ' A' ' 66' ' ' MET . 20.6 t70 -62.19 -34.84 77.22 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.403 -0.817 . . . . 71.11 111.005 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -83.5 -6.94 59.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.594 -0.73 . . . . 74.13 111.913 -178.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -104.2 -3.77 23.95 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.571 -0.452 . . . . 75.41 111.24 -179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.447 ' HE3' ' CD2' ' B' ' 277' ' ' LEU . 42.0 mtt -89.82 -167.04 1.74 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.234 -0.439 . . . . 53.41 111.293 176.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.4 mt-10 70.29 -12.25 0.52 Allowed 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.057 -0.974 . . . . 75.13 113.376 176.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -57.97 -57.76 11.38 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.051 0.453 . . . . 71.24 110.129 175.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -72.58 -16.24 61.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.043 -0.526 . . . . 65.51 111.475 177.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' B' ' 282' ' ' GLU . 56.1 mt -76.55 -56.98 6.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.488 -0.323 . . . . 64.34 110.234 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.3 pt-20 -62.18 -34.19 75.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.448 -0.342 . . . . 72.1 110.775 179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -87.99 6.56 35.37 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.344 -0.389 . . . . 71.54 111.724 -176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.515 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 44.2 t80 -56.43 -47.76 78.41 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.321 -0.622 . . . . 64.42 109.321 174.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -59.59 -41.15 89.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.748 -0.66 . . . . 71.51 110.407 176.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -59.88 -54.52 45.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.852 -0.613 . . . . 75.12 110.349 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . 0.42 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 66.3 m-85 -62.53 -48.51 79.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.086 -0.506 . . . . 73.22 110.813 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.53 -19.61 57.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.036 -0.529 . . . . 73.05 111.16 -177.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.04 -37.02 13.7 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.973 -0.558 . . . . 74.32 110.889 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 38.5 p -75.32 -22.51 57.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.331 -0.395 . . . . 60.25 110.96 177.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 16.1 mt-30 -103.4 131.19 50.7 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 115.938 -0.574 . . . . 74.12 110.133 -177.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . 0.465 ' HD2' ' N ' ' B' ' 296' ' ' LYS . 9.9 mptt . . . . . 0 C--O 1.252 1.185 0 CA-C-O 118.355 -0.831 . . . . 74.12 109.097 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.476 0.869 0 N-CA-C 110.022 -0.362 . . . . 61.41 110.022 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -78.18 -9.93 59.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.106 0.479 . . . . 72.41 111.016 -178.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.9 p-10 -99.84 149.7 23.11 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.9 -0.591 . . . . 51.32 109.81 176.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.598 ' HB3' ' HE2' ' A' ' 8' ' ' TYR . 37.5 tt0 -65.8 -81.12 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.234 -0.439 . . . . 72.25 111.19 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -124.14 -27.56 3.83 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.175 0.512 . . . . 73.12 110.24 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.478 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -106.38 167.86 9.54 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.004 -0.544 . . . . 61.55 111.329 -175.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.2 OUTLIER -78.7 47.18 0.71 Allowed 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.427 -0.806 . . . . 74.21 111.643 -178.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.598 ' HE2' ' HB3' ' A' ' 4' ' ' GLU . 75.2 m-85 -49.37 -48.54 46.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.344 -0.389 . . . . 71.44 111.591 -177.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.4 -26.27 67.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.041 -0.527 . . . . 23.2 112.2 -175.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.475 ' HA ' ' HD3' ' A' ' 10' ' ' ARG . 27.1 mmt180 -81.39 -51.49 8.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.269 -0.172 . . . . 71.11 111.404 -178.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.656 ' HB1' ' HB2' ' B' ' 239' ' ' ALA . . . -63.6 -23.5 67.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.874 0.845 . . . . 70.44 109.701 -178.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.8 m -58.63 -33.47 70.08 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-N 114.124 -1.398 . . . . 72.31 111.22 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.593 ' HB2' HD11 ' B' ' 217' ' ' LEU . 28.1 mt-10 -79.15 -31.9 44.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.374 0.607 . . . . 75.41 109.469 -177.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.634 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -63.01 -43.46 98.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.019 -0.991 . . . . 75.25 109.533 177.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.68 HG23 ' HD2' ' B' ' 243' ' ' TYR . 84.9 mt -69.91 -33.09 54.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.348 -0.842 . . . . 72.45 110.598 177.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -61.59 -31.14 71.19 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.9 -0.591 . . . . 74.53 111.055 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.548 HD12 HD22 ' B' ' 214' ' ' LEU . 2.8 tm? -69.71 -45.92 67.12 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.05 -0.722 . . . . 72.33 109.05 176.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.77 -39.27 84.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.968 -0.56 . . . . 71.21 110.808 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.91 -21.47 66.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.281 -0.418 . . . . 72.43 111.396 178.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -33.95 34.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.012 0.435 . . . . 72.5 109.865 178.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.3 mt-30 -78.69 -24.3 45.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.245 0.545 . . . . 75.43 110.025 177.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.492 ' OD1' HG23 ' A' ' 29' ' ' THR . 0.2 OUTLIER -70.49 -10.91 60.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.49 -0.777 . . . . 65.53 109.577 179.003 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -78.83 -9.75 59.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.584 -0.734 . . . . 75.12 110.737 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.463 HD22 HG13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -70.43 159.64 33.84 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.154 0.502 . . . . 64.34 110.977 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.6 t -121.37 -16.57 7.84 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.469 -0.787 . . . . 72.1 110.239 -177.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -88.74 3.71 49.96 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.515 -0.766 . . . . 74.0 111.021 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.726 HG22 ' H ' ' A' ' 28' ' ' GLN . 1.6 mt -128.25 -174.72 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.157 -0.474 . . . . 73.13 109.742 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.843 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 41.5 mt-30 -120.4 160.57 22.82 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.389 -0.597 . . . . 45.23 109.389 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.519 HG22 ' HZ ' ' B' ' 247' ' ' PHE . 58.6 m -64.01 -38.56 91.53 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.024 0.44 . . . . 73.45 110.802 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -66.75 -29.56 74.89 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.086 -0.578 . . . . 71.45 112.979 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.843 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 8.5 mm-40 -68.99 -35.76 77.06 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.312 0.577 . . . . 64.33 109.596 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.41 HG21 ' HA ' ' A' ' 22' ' ' ASN . 47.8 t -63.84 -43.97 98.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.176 -0.92 . . . . 71.4 109.819 176.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.1 t -61.08 -42.93 99.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.719 -0.673 . . . . 73.4 110.438 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.29 72.39 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.888 -0.596 . . . . 61.34 111.279 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.518 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 16.2 m -66.71 -33.13 74.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 N-CA-C 109.775 -0.454 . . . . 71.12 109.775 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.647 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.0 t80 -67.11 -41.09 86.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.3 0.572 . . . . 72.23 109.538 177.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.72 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.0 ttm -64.65 -48.47 74.7 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.51 -0.768 . . . . 75.12 111.427 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.517 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 27.4 t-105 -64.21 -37.15 86.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.914 0.387 . . . . 74.34 110.916 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.581 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -65.44 -36.38 83.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.962 0.41 . . . . 33.54 110.657 178.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.756 HD21 ' SD ' ' B' ' 237' ' ' MET . 58.6 tp -68.52 -36.96 79.58 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 74.42 109.703 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -60.0 -33.25 71.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.644 -0.707 . . . . 65.31 111.076 177.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -78.5 -52.51 8.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.13 -0.486 . . . . 74.12 110.733 178.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.445 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 20.2 t80 -65.42 -42.28 92.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.39 -0.823 . . . . 74.23 111.549 -173.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -80.24 -25.14 39.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.405 -0.362 . . . . 64.31 111.652 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.616 ' HB2' ' HG ' ' B' ' 277' ' ' LEU . . . -81.28 -21.03 39.63 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.081 0.467 . . . . 74.12 110.54 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.445 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 11.3 t90 -56.63 -32.92 65.78 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.403 -0.817 . . . . 71.13 110.553 176.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -72.51 -9.0 58.02 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 71.2 111.532 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -67.79 -30.92 74.86 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.468 -0.872 . . . . 70.13 111.066 174.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 t -71.62 -2.96 18.99 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 120.747 0.308 . . . . 43.14 111.212 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.8 t -127.25 16.18 7.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.194 0.521 . . . . 53.34 109.978 174.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.5 t -74.17 -47.9 32.74 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.943 -0.571 . . . . 70.13 111.203 -175.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.643 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -134.03 -176.09 4.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.126 0.489 . . . . 74.21 112.078 -176.48 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.643 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.2 pt-20 -97.63 -25.59 15.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.133 -0.939 . . . . 75.51 111.881 -171.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.536 ' HA ' ' CE2' ' B' ' 288' ' ' PHE . 67.7 p -135.92 157.76 46.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.199 -0.455 . . . . 73.11 109.785 178.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.561 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 9.8 ptmm? -71.64 -30.59 65.93 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.547 -0.461 . . . . 72.04 110.322 -177.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.74 -38.78 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.062 -0.517 . . . . 61.2 110.414 -178.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.697 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 23.0 mt-30 -88.05 -38.14 15.7 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.74 -0.664 . . . . 63.22 110.265 -179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.5 ttt -60.07 -40.86 91.01 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.144 0.497 . . . . 72.52 111.182 178.084 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 37.2 tt0 -63.37 -31.39 72.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.607 -0.724 . . . . 62.24 110.823 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.78 1.89 47.79 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.044 -0.525 . . . . 64.31 111.07 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.697 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -111.9 -0.99 15.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.092 -0.504 . . . . 71.23 109.715 178.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 8.3 ttmm -51.39 -62.7 1.46 Allowed 'General case' 0 N--CA 1.448 -0.559 0 CA-C-N 115.413 -0.812 . . . . 72.53 110.285 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -75.64 -11.92 60.1 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.548 -0.751 . . . . 63.21 110.471 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -75.42 -49.89 17.54 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.729 -0.668 . . . . 73.12 110.767 178.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.507 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.2 ptt? -79.76 -26.7 40.61 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.253 0.549 . . . . 75.43 109.846 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.444 ' HG2' HD22 ' B' ' 277' ' ' LEU . 92.4 mtp -79.14 -2.12 39.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.641 -0.709 . . . . 72.13 110.522 178.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -74.47 -27.57 60.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.418 -0.956 . . . . 61.3 108.418 179.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.462 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 26.5 m-85 -102.82 -30.12 11.04 Favored 'General case' 0 N--CA 1.444 -0.737 0 CA-C-N 114.111 -1.404 . . . . 75.35 111.995 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -56.28 -58.31 8.52 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.011 -0.737 . . . . 73.22 109.011 175.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.523 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -56.9 -59.53 4.9 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.499 -0.318 . . . . 75.12 110.992 173.31 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -107.42 75.59 1.03 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.703 0.631 . . . . 73.13 112.703 -170.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.462 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 2.1 mmm180 -140.52 -29.95 0.67 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.841 -0.618 . . . . 74.34 110.323 166.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.05 7.42 24.69 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 108.727 -0.842 . . . . 71.2 108.727 177.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -59.59 -60.22 4.19 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.732 -1.122 . . . . 62.11 110.417 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -63.31 -32.39 73.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.89 -0.595 . . . . 73.01 111.517 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.465 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 53.0 mtt -59.76 -48.92 79.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.556 0.693 . . . . 72.11 109.321 172.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.737 HD21 ' HD2' ' B' ' 269' ' ' TYR . 17.6 tp -63.32 -38.27 90.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.416 -1.266 . . . . 74.12 110.628 -176.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.406 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 10.4 t70 -63.19 -53.93 45.48 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.771 -0.65 . . . . 64.13 110.199 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.12 -12.92 61.95 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.064 -0.971 . . . . 65.22 111.604 -178.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.0 -10.26 39.93 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.383 -0.371 . . . . 64.31 110.939 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.46 ' O ' HG13 ' A' ' 85' ' ' ILE . 63.4 mtt -101.12 -55.28 2.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.399 -0.364 . . . . 72.21 111.246 178.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.582 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 11.5 pt-20 -68.64 -14.89 63.31 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.852 0.686 . . . . 73.45 112.852 -169.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -71.09 -33.27 70.03 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.445 -0.576 . . . . 62.2 109.445 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 7.6 m-30 -77.23 -38.41 51.28 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.859 -0.61 . . . . 75.34 110.215 170.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.647 HD13 ' HA ' ' B' ' 259' ' ' GLN . 68.1 mt -59.22 -54.84 28.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.854 -0.612 . . . . 72.41 110.932 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.829 ' HA ' ' HE3' ' B' ' 255' ' ' LYS . 8.4 pt-20 -58.82 -33.87 70.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.454 -0.339 . . . . 70.31 111.559 -178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -94.24 17.51 12.59 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.681 -0.236 . . . . 64.52 111.497 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.494 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 22.2 t80 -53.14 -51.69 61.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.707 -0.224 . . . . 74.41 110.996 178.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -59.85 -28.7 67.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.246 -0.434 . . . . 75.14 111.27 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.8 t60 -71.67 -53.25 14.17 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.98 0.419 . . . . 73.23 110.01 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.499 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 75.0 m-85 -64.17 -35.43 80.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.228 -0.442 . . . . 63.11 110.833 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.418 ' HA ' ' HD2' ' A' ' 92' ' ' ARG . 0.3 OUTLIER -70.45 -8.22 49.32 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.593 0.711 . . . . 74.53 110.511 178.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -98.9 -26.78 14.17 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.957 -0.565 . . . . 62.42 110.583 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 46.8 p -84.92 -30.25 24.49 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.101 -0.499 . . . . 62.21 110.888 178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 0.2 OUTLIER -119.14 155.66 31.21 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.946 0.403 . . . . 64.04 110.286 178.132 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.47 ' HB2' ' NZ ' ' A' ' 96' ' ' LYS . 9.5 mtmp? . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 115.827 -0.624 . . . . 73.03 110.735 -175.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 120.754 0.311 . . . . 55.1 110.541 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -69.86 -21.93 63.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.107 0.48 . . . . 74.4 110.777 178.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.3 p-10 -154.96 136.28 14.06 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.053 -0.721 . . . . 74.43 109.053 173.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -89.46 -92.51 0.12 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.88 0.371 . . . . 73.52 110.975 -176.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -95.4 -28.75 14.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.437 0.637 . . . . 71.1 109.483 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -103.87 160.58 14.68 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.26 -0.882 . . . . 70.41 110.882 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.518 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -82.06 48.34 1.23 Allowed 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 114.978 -1.01 . . . . 63.12 111.617 -177.641 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.517 ' HD2' ' HA ' ' B' ' 203' ' ' ASN . 53.7 m-85 -46.98 -53.55 12.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.242 -0.435 . . . . 75.1 111.921 -175.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . 0.416 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -58.88 -36.4 74.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.897 -0.592 . . . . 61.12 112.247 -176.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.483 ' O ' HD23 ' B' ' 214' ' ' LEU . 35.7 mmt180 -71.63 -48.94 44.58 Favored 'General case' 0 C--O 1.222 -0.357 0 N-CA-C 111.75 0.278 . . . . 61.24 111.75 -176.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.581 ' HB1' ' HB2' ' A' ' 39' ' ' ALA . . . -63.88 -26.54 68.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.951 0.882 . . . . 75.43 109.585 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . 0.416 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 3.1 m -62.54 -32.73 73.73 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.254 -1.339 . . . . 70.11 111.611 175.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 32.8 mt-10 -75.35 -28.75 59.71 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 121.553 0.692 . . . . 72.45 109.247 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.647 HD12 ' CD1' ' A' ' 36' ' ' PHE . 3.4 mm? -65.37 -44.39 87.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.996 -1.002 . . . . 75.33 109.578 176.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.435 HG23 ' HD2' ' A' ' 43' ' ' TYR . 75.2 mt -69.15 -27.93 36.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.441 -0.799 . . . . 73.15 110.389 177.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.452 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 14.2 tmtt? -60.15 -35.09 74.53 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 116.079 -0.51 . . . . 61.22 110.931 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.0 tm? -69.77 -42.25 74.07 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.968 -0.753 . . . . 74.13 108.968 177.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.33 84.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.84 -0.618 . . . . 74.01 110.797 178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 93.6 m-20 -60.61 -26.11 66.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.804 -0.634 . . . . 72.22 111.165 179.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.31 -31.85 43.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.594 -0.276 . . . . 72.44 111.2 -179.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 85.9 mt-30 -80.69 -28.06 36.84 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.479 0.656 . . . . 71.11 110.594 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -75.44 -1.47 24.21 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.185 -0.916 . . . . 71.12 110.672 -178.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.9 mm-40 -79.28 -0.56 32.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.06 -0.518 . . . . 73.31 111.613 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 1.0 HD22 HG13 ' B' ' 227' ' ' ILE . 43.2 t30 -80.06 164.9 23.04 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.015 0.436 . . . . 63.21 110.49 -178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 1.5 t -96.18 -40.11 9.35 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.82 -0.627 . . . . 50.33 112.468 -173.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -100.16 3.18 43.64 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 112.91 0.707 . . . . 75.24 112.91 -175.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 1.0 HG13 HD22 ' B' ' 224' ' ' ASN . 12.7 mt -94.88 147.41 5.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 C-N-CA 120.192 -0.603 . . . . 71.42 109.565 175.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.577 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 37.2 mt-30 -84.01 147.37 27.46 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.569 -0.741 . . . . 73.41 109.365 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 7.8 m -57.3 -27.43 62.15 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.277 0.561 . . . . 54.14 110.282 177.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -76.65 -21.16 75.4 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.577 -0.738 . . . . 60.35 113.41 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.577 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 12.4 mm-40 -72.29 -30.98 65.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.64 0.72 . . . . 60.25 110.088 -176.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.3 t -69.73 -39.85 78.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.293 -0.867 . . . . 72.21 109.502 176.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.9 t -62.56 -38.49 90.29 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.78 -0.645 . . . . 61.14 109.744 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.27 -36.33 82.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.949 -0.568 . . . . 71.42 110.796 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.475 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.2 m -66.44 -35.21 79.74 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.686 -0.487 . . . . 73.13 109.686 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.558 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.0 t80 -66.96 -37.57 84.53 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.774 -0.648 . . . . 74.55 109.655 176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.756 ' SD ' HD21 ' A' ' 40' ' ' LEU . 8.6 tpt -63.64 -52.45 60.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.799 -0.637 . . . . 75.34 110.729 179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.465 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 22.3 t-105 -63.48 -38.41 91.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.96 -0.564 . . . . 74.41 111.332 179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.656 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -65.72 -31.85 73.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.547 -0.297 . . . . 60.41 111.392 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' B' ' 244' ' ' ASN . 44.4 tp -64.85 -38.52 91.27 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.864 -0.421 . . . . 62.11 109.864 177.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.543 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.267 -0.424 . . . . 71.21 110.312 177.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . 0.409 ' NE ' ' HA ' ' B' ' 242' ' ' ARG . 1.0 OUTLIER -58.68 -48.86 79.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.918 -0.583 . . . . 75.22 111.53 178.022 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.68 ' HD2' HG23 ' A' ' 15' ' ' ILE . 11.3 t80 -75.33 -36.85 60.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.968 -0.56 . . . . 73.34 111.494 -173.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' B' ' 240' ' ' LEU . 9.0 t-20 -74.88 -40.52 60.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.835 0.35 . . . . 74.11 111.266 -176.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.426 ' HB2' HD12 ' A' ' 77' ' ' LEU . . . -66.82 -22.47 66.0 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.932 0.396 . . . . 62.23 111.272 -178.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . 0.407 ' HB3' ' O ' ' B' ' 243' ' ' TYR . 13.2 t90 -57.56 -31.81 66.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.606 -0.724 . . . . 63.34 110.565 175.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.519 ' HZ ' HG22 ' A' ' 29' ' ' THR . 71.3 m-85 -74.79 -11.03 60.06 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.238 -0.437 . . . . 73.02 111.526 179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -70.13 -31.35 69.27 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.477 -0.868 . . . . 55.34 111.186 175.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.86 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 22.6 t -74.15 -7.84 54.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.807 0.337 . . . . 70.35 110.942 -176.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -120.86 21.59 11.37 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.354 0.597 . . . . 71.22 109.613 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 7.2 t -91.0 -38.69 12.66 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.691 -0.686 . . . . 62.2 111.289 -175.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.617 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -138.0 -170.07 2.7 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.204 0.526 . . . . 75.52 111.955 -176.888 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.414 ' HG3' ' N ' ' B' ' 254' ' ' THR . 14.7 pt-20 -100.38 -49.82 4.12 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.349 -0.842 . . . . 73.33 111.237 -176.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.414 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 70.4 p -111.28 155.98 22.2 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.521 -0.309 . . . . 42.33 110.391 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.829 ' HE3' ' HA ' ' A' ' 86' ' ' GLU . 5.9 ptmm? -68.29 -27.26 66.16 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.812 -0.355 . . . . 62.32 110.588 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -57.25 -53.86 53.37 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.135 0.493 . . . . 71.32 110.327 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.692 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 14.4 mt-30 -79.1 -36.01 41.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.717 -0.674 . . . . 73.31 110.372 -177.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.86 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 20.4 ttt -61.9 -40.04 94.07 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.747 -0.661 . . . . 53.15 111.047 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.647 ' HA ' HD13 ' A' ' 85' ' ' ILE . 4.8 tp-100 -59.98 -41.57 92.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.957 -0.565 . . . . 70.11 110.823 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.99 -17.29 62.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.777 -0.647 . . . . 71.31 111.064 -178.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.692 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.3 mmmt -91.58 -18.16 24.5 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 116.118 -0.492 . . . . 72.23 110.523 -176.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -48.41 -61.64 1.91 Allowed 'General case' 0 N--CA 1.443 -0.818 0 O-C-N 123.709 0.63 . . . . 53.41 110.439 -178.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -68.01 -26.02 65.68 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.004 -0.544 . . . . 73.13 111.021 -177.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -74.26 -35.94 63.81 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.988 -0.285 . . . . 75.22 111.453 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 19.0 ptp -83.65 -25.32 30.86 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 109.104 -0.702 . . . . 61.41 109.104 -179.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.406 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 58.9 mtp -80.7 -24.67 38.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.16 -0.927 . . . . 73.41 111.784 179.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -58.18 -35.69 71.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.909 0.385 . . . . 62.43 111.93 -168.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.59 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 25.2 p90 -103.33 -3.41 25.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.291 -0.413 . . . . 70.14 110.903 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.737 ' HD2' HD21 ' A' ' 77' ' ' LEU . 2.1 m-30 -65.84 -42.72 90.16 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.452 0.168 . . . . 75.41 111.115 -178.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -44.62 83.96 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.538 0.685 . . . . 74.2 109.577 174.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -86.06 17.39 3.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.98 -1.009 . . . . 73.35 111.621 -172.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.59 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 2.0 mmm180 -89.61 -47.88 7.67 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.501 -0.749 . . . . 64.45 110.94 -174.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.72 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.22 12.23 33.63 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-O 121.099 0.476 . . . . 72.24 109.796 -176.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -58.43 -57.98 10.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.41 -0.814 . . . . 63.23 110.341 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -60.76 -37.99 83.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.723 -0.671 . . . . 64.2 111.111 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 48.9 mtt -59.59 -45.55 91.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.433 0.635 . . . . 55.33 110.092 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.616 ' HG ' ' HB2' ' A' ' 45' ' ' ALA . 6.3 tt -71.56 -42.1 68.26 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.175 -0.92 . . . . 71.33 110.413 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -56.8 -41.98 78.68 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.468 0.651 . . . . 71.45 110.301 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.06 -13.32 62.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.902 -1.044 . . . . 73.13 112.189 -177.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -98.9 -7.95 26.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.987 0.422 . . . . 75.21 110.391 179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.523 ' HG3' ' HB1' ' A' ' 45' ' ' ALA . 55.1 mtt -94.19 -50.77 5.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.221 -0.445 . . . . 74.02 111.08 176.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 0.0 OUTLIER -57.13 -25.8 59.45 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.49 -0.777 . . . . 72.22 111.968 -173.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.56 -42.57 92.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.055 -0.52 . . . . 64.02 110.448 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -82.36 -34.47 28.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.924 -0.58 . . . . 71.45 110.516 177.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.448 HG13 ' O ' ' B' ' 281' ' ' MET . 69.0 mt -58.22 -58.02 8.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 116.228 -0.442 . . . . 74.11 111.677 -177.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.0 pt-20 -64.49 -29.06 70.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.34 -0.391 . . . . 74.12 111.346 -175.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 -100.04 12.45 36.86 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.721 -0.218 . . . . 64.53 111.342 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.561 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 78.3 t80 -55.31 -56.94 14.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.727 -0.215 . . . . 60.52 111.19 -177.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -65.98 -21.69 66.43 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.82 0.343 . . . . 71.33 110.598 -176.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -66.33 -52.99 41.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.425 -0.583 . . . . 65.01 109.425 175.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -66.87 -38.21 85.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.332 0.587 . . . . 73.21 110.334 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.455 ' HA ' ' HG2' ' B' ' 295' ' ' GLN . 3.7 tmm_? -67.29 -17.69 64.88 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.131 -0.941 . . . . 73.45 110.284 -179.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.6 -25.74 19.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 75.42 111.032 -179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 32.7 p -91.92 -18.71 23.35 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.322 -0.399 . . . . 55.23 111.153 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.455 ' HG2' ' HA ' ' B' ' 292' ' ' ARG . 18.5 pt20 -80.83 142.78 33.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.483 0.659 . . . . 73.11 110.614 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 50.3 mttp . . . . . 0 C--O 1.247 0.972 0 CA-C-N 115.185 -0.916 . . . . 74.2 108.949 178.369 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.4 t . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 120.61 0.243 . . . . 73.33 110.497 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -81.51 148.61 29.1 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 110.071 -0.344 . . . . 63.2 110.071 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.709 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.7 p-10 -77.9 136.83 38.09 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.483 -0.562 . . . . 62.32 109.483 175.547 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -67.99 -83.4 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.021 0.438 . . . . 75.11 111.0 -176.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.9 p-10 -111.9 -42.16 3.85 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.854 -0.612 . . . . 71.41 109.511 177.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.709 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -93.45 154.02 18.16 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.859 -0.61 . . . . 75.4 110.097 174.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.452 ' HB2' ' HD2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -78.36 51.91 1.08 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.602 -0.726 . . . . 74.11 112.478 -177.333 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 53.7 m-85 -51.91 -46.95 64.81 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 120.847 0.356 . . . . 72.02 111.46 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.2 -6.07 36.76 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.913 -0.585 . . . . 75.43 112.359 -173.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 84.7 mtt180 -100.11 -60.71 1.48 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.926 -0.398 . . . . 73.23 109.926 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.27 -25.65 24.63 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.594 0.59 . . . . 52.53 112.594 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.9 t -62.13 -26.53 68.37 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.743 -0.208 . . . . 73.05 111.362 -178.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.565 ' HB2' HD11 ' B' ' 217' ' ' LEU . 26.5 mt-10 -84.39 -25.14 29.3 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-O 121.354 0.597 . . . . 75.25 109.705 -178.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.74 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -68.56 -49.53 58.76 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.31 -0.859 . . . . 71.5 109.203 177.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.525 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.2 mt -64.91 -29.28 46.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.643 -0.708 . . . . 71.34 109.807 175.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 12' ' ' THR . 2.4 tmmt? -62.5 -38.0 88.2 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.804 -0.634 . . . . 74.22 111.085 179.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.5 HD12 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -65.92 -47.42 74.83 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.873 -0.788 . . . . 54.04 108.873 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.59 -35.85 70.96 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.39 -0.823 . . . . 70.13 110.969 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.627 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 5.1 m-80 -58.94 -34.5 71.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 75.11 111.347 179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.0 -41.58 67.45 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.242 -0.435 . . . . 72.23 111.271 -178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -74.11 -20.51 60.23 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.346 0.593 . . . . 73.14 109.909 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.603 HD21 HG23 ' A' ' 29' ' ' THR . 2.9 t-20 -83.51 -4.91 58.96 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.302 -0.863 . . . . 74.44 110.751 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.627 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 26.4 mt-30 -82.54 17.83 1.67 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.396 -0.365 . . . . 72.45 111.162 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.849 HD22 HG13 ' A' ' 27' ' ' ILE . 18.6 t30 -105.33 156.96 17.66 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.759 0.314 . . . . 72.4 110.616 -177.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.4 t -100.63 -37.02 8.94 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.837 0.68 . . . . 72.44 112.837 -171.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 22.8 pm0 -85.23 -2.44 58.05 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.752 -0.379 . . . . 72.42 110.951 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.849 HG13 HD22 ' A' ' 24' ' ' ASN . 8.6 mt -96.91 145.44 8.92 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.526 0.679 . . . . 64.34 110.252 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.653 ' HB2' ' HG3' ' A' ' 31' ' ' GLU . 9.0 mt-30 -79.66 140.71 36.97 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.716 -1.129 . . . . 65.42 108.105 174.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.603 HG23 HD21 ' A' ' 22' ' ' ASN . 17.4 m -58.38 -24.83 61.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 120.987 0.422 . . . . 72.21 111.06 -176.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -82.17 -11.73 81.9 Favored Glycine 0 N--CA 1.447 -0.58 0 CA-C-N 115.868 -0.605 . . . . 73.05 113.833 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.653 ' HG3' ' HB2' ' A' ' 28' ' ' GLN . 50.2 mt-10 -70.21 -31.31 68.68 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 117.97 0.885 . . . . 70.45 110.286 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 19.0 t -79.45 -32.76 14.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.642 -0.708 . . . . 64.11 109.901 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.66 -42.57 98.06 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.608 -0.723 . . . . 72.31 110.202 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.04 -36.22 81.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.624 -0.716 . . . . 73.54 111.177 -179.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.452 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 3.6 p -71.96 -27.71 62.96 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.35 110.458 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.593 ' CD1' HD12 ' B' ' 214' ' ' LEU . 11.4 t80 -69.6 -37.57 76.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.415 -0.587 . . . . 72.21 109.415 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.751 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 12.1 ttt -72.73 -49.85 28.4 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.892 -0.595 . . . . 74.14 111.104 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -52.4 -41.66 63.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.497 -0.774 . . . . 75.55 110.831 174.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.542 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.97 -33.78 76.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.071 -0.513 . . . . 63.13 111.348 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.562 HD21 ' HG3' ' B' ' 237' ' ' MET . 58.3 tp -65.65 -35.64 81.37 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 121.024 0.44 . . . . 71.02 110.136 179.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.446 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -63.4 -44.26 95.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.783 -0.644 . . . . 72.4 110.715 178.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -67.21 -24.12 65.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.215 -0.448 . . . . 61.44 110.99 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.411 ' HD1' HG23 ' B' ' 215' ' ' ILE . 3.1 t80 -90.02 -47.43 7.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.29 -0.414 . . . . 65.12 110.836 -176.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -65.44 -26.04 67.79 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.1 0.407 . . . . 73.13 112.1 -177.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.43 -14.53 62.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.787 0.327 . . . . 65.22 111.259 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 81.3 t90 -61.58 -31.92 72.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 75.05 110.342 176.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.882 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 55.0 m-85 -70.65 -12.99 61.9 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-N 116.173 -0.467 . . . . 71.42 111.226 -178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.505 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -65.54 -32.63 83.91 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.22 -0.991 . . . . 52.34 110.643 173.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.903 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 15.3 m -78.23 -9.57 59.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.009 0.433 . . . . 30.52 110.857 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 63.2 p -106.71 -3.1 20.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.184 0.516 . . . . 55.31 110.324 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.1 t -72.84 -43.37 62.73 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.67 -0.696 . . . . 75.03 110.522 -175.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.47 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 11.0 m-85 -149.72 178.1 9.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.921 -0.582 . . . . 71.14 110.596 -177.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.425 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.6 pt-20 -98.61 -52.65 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.059 -0.519 . . . . 60.13 111.129 -177.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.425 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.6 p -88.01 148.59 24.45 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-N 116.596 -0.275 . . . . 72.43 110.523 -178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.427 ' HB2' ' HE2' ' A' ' 55' ' ' LYS . 7.8 ptmm? -66.28 -25.34 66.82 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.869 -0.332 . . . . 75.11 110.62 -178.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -64.59 -41.65 96.11 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.24 -0.437 . . . . 71.51 110.613 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.725 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.6 mt-30 -85.93 -37.99 18.48 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.996 -0.547 . . . . 71.35 109.806 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.903 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.6 ttt -63.88 -43.43 96.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.586 -0.734 . . . . 63.33 111.618 -177.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.575 ' HA ' HD13 ' B' ' 285' ' ' ILE . 42.9 tt0 -68.86 -34.92 76.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.36 -0.382 . . . . 75.53 111.154 -176.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.07 2.56 10.35 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.205 -0.452 . . . . 73.14 111.613 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.725 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.6 mmmt -113.52 -2.44 13.87 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 110.092 -0.336 . . . . 63.13 110.092 -177.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.537 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 0.2 OUTLIER -49.74 -57.9 6.38 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 123.721 0.638 . . . . 75.42 110.889 -175.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -80.07 -20.96 43.98 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 110.254 -0.276 . . . . 74.24 110.254 -177.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -73.53 -39.61 64.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.443 -0.344 . . . . 63.42 111.866 -178.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.5 ptt? -84.32 -19.12 34.24 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 119.9 -0.72 . . . . 60.3 109.483 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.402 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 46.0 mtp -85.35 -21.85 28.72 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.276 -0.874 . . . . 73.02 111.35 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -57.34 -41.32 79.79 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.114 0.483 . . . . 53.3 111.072 -171.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.595 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 29.6 p90 -96.99 -8.12 31.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.863 -0.608 . . . . 75.24 111.073 -178.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.524 ' HD2' HD21 ' B' ' 277' ' ' LEU . 2.6 m-30 -61.4 -40.16 93.38 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 120.576 0.227 . . . . 72.35 111.009 -179.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.617 ' SD ' ' HE3' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -55.69 -50.75 69.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.323 0.582 . . . . 73.11 110.224 174.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.539 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 1.9 t70 -88.02 27.45 1.19 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.238 -0.892 . . . . 71.2 111.467 -170.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.595 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 17.3 mmm180 -91.95 -54.45 3.85 Favored 'General case' 0 N--CA 1.464 0.236 0 O-C-N 122.17 -0.331 . . . . 61.44 111.317 -177.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.748 ' HB3' ' HG2' ' B' ' 237' ' ' MET . 0.1 OUTLIER -79.33 5.62 12.03 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.181 0.515 . . . . 71.21 110.527 -177.372 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.74 -45.93 92.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.501 -0.772 . . . . 73.4 110.684 -179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.51 -33.11 74.96 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.726 -0.67 . . . . 72.35 111.097 -178.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -69.2 -41.1 77.58 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.341 0.591 . . . . 64.53 109.951 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.49 ' HB3' ' CE ' ' B' ' 266' ' ' MET . 0.7 OUTLIER -65.36 -38.84 91.26 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.906 -1.043 . . . . 74.23 111.423 -174.539 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.445 ' N ' ' HE1' ' B' ' 266' ' ' MET . 28.8 t70 -65.21 -33.56 76.29 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.1 0.476 . . . . 52.12 110.795 -178.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.96 -14.84 61.1 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.895 -0.593 . . . . 73.35 110.753 179.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -92.22 -20.39 21.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.978 -0.555 . . . . 71.44 110.383 179.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.44 ' C ' ' H ' ' A' ' 83' ' ' ASP . 24.0 mmt -77.2 -168.26 1.07 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.935 -0.575 . . . . 54.34 110.936 177.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 1.051 ' HA ' HD12 ' A' ' 85' ' ' ILE . 48.6 mt-10 66.98 -7.69 0.47 Allowed 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 114.994 -1.003 . . . . 72.13 112.201 -178.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.468 ' O ' HG13 ' A' ' 85' ' ' ILE . 41.8 t0 -79.15 150.61 31.67 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.732 -0.84 . . . . 75.51 108.732 172.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.467 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 3.1 m-85 73.13 -40.92 0.49 Allowed 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.589 1.155 . . . . 73.32 110.672 -172.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 1.051 HD12 ' HA ' ' A' ' 82' ' ' GLU . 7.4 mt -56.72 -57.63 8.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.269 -0.878 . . . . 73.32 111.131 177.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.479 ' HG3' ' ND2' ' A' ' 87' ' ' ASN . 7.9 pt-20 -57.75 -26.54 61.98 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.172 -0.922 . . . . 70.32 111.356 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.479 ' ND2' ' HG3' ' A' ' 86' ' ' GLU . 56.6 m-80 -100.43 2.82 42.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.316 -0.402 . . . . 74.41 111.47 -175.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.551 ' O ' ' HB2' ' A' ' 92' ' ' ARG . 59.3 t80 -58.72 -48.22 81.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.833 -0.347 . . . . 72.33 110.452 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -63.77 -31.74 73.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.079 -0.51 . . . . 74.33 110.334 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.407 ' HB3' ' O ' ' A' ' 87' ' ' ASN . 6.2 t60 -63.12 -55.91 21.32 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.783 -0.644 . . . . 73.14 110.013 177.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -64.04 -43.43 95.56 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 74.13 110.703 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.551 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -63.26 -20.17 65.22 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.806 -0.634 . . . . 63.4 111.307 -179.019 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -88.78 -35.35 16.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.122 -0.49 . . . . 64.51 110.791 -178.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.2 p -80.73 -34.16 34.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.089 -0.505 . . . . 62.42 111.46 -178.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -75.72 153.03 37.33 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.931 0.396 . . . . 51.04 110.176 -178.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 57.2 mttp . . . . . 0 C--N 1.321 -0.653 0 CA-C-N 116.094 -0.503 . . . . 63.21 110.594 -175.014 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . 0.42 ' HA ' ' CB ' ' B' ' 209' ' ' ALA . 32.0 t . . . . . 0 C--O 1.234 0.264 0 CA-C-O 121.133 0.492 . . . . 72.52 110.191 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -94.85 104.97 16.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.121 -0.49 . . . . 74.44 110.251 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -90.97 154.69 19.27 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.166 -0.47 . . . . 72.44 111.056 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -86.62 -86.51 0.15 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.997 -0.547 . . . . 63.15 110.321 173.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -111.6 -24.83 9.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.063 0.459 . . . . 62.12 110.546 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -94.76 -160.41 0.78 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.942 -0.572 . . . . 63.24 111.608 -176.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.452 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -127.29 44.47 2.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.649 -0.705 . . . . 72.4 110.907 -176.575 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -52.89 -49.11 66.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.936 -0.575 . . . . 74.44 111.927 -176.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . 0.42 ' CB ' ' HA ' ' B' ' 201' ' ' SER . . . -58.99 -25.57 63.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.82 -0.627 . . . . 65.33 112.027 -178.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -82.64 -60.64 2.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 110.184 -0.302 . . . . 73.52 110.184 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.602 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -56.69 -27.29 58.6 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.872 0.693 . . . . 72.23 112.872 -176.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 5.1 t -68.59 -20.16 64.5 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 120.851 0.358 . . . . 73.23 110.976 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -80.81 -31.5 35.59 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.479 0.657 . . . . 75.15 109.283 178.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.602 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -66.4 -50.58 62.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.867 -1.06 . . . . 72.2 110.017 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.542 HG13 ' HB1' ' A' ' 39' ' ' ALA . 75.0 mt -63.82 -32.05 55.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 115.878 -0.601 . . . . 71.51 110.373 177.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -60.11 -34.09 73.02 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.462 -0.79 . . . . 71.44 110.985 -177.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.649 HD12 HD13 ' A' ' 14' ' ' LEU . 3.3 tm? -69.7 -40.42 76.34 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.288 -0.634 . . . . 64.31 109.288 178.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -63.06 -31.83 73.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.014 -0.539 . . . . 73.31 110.674 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -63.74 -31.62 72.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.928 0.394 . . . . 73.23 110.76 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.11 -18.05 53.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.114 -0.494 . . . . 63.13 111.131 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . 0.408 ' OE1' HD21 ' A' ' 14' ' ' LEU . 70.5 mt-30 -92.38 -25.04 18.69 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.232 0.539 . . . . 62.51 110.021 176.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . 0.405 HD22 ' HA ' ' B' ' 222' ' ' ASN . 3.0 t-20 -79.14 4.46 14.67 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.753 -0.658 . . . . 65.24 109.968 177.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -73.47 -10.68 59.97 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.012 -0.736 . . . . 75.11 109.012 172.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.69 HD22 ' HG2' ' B' ' 226' ' ' GLU . 2.7 m120 -77.78 134.87 37.95 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.078 -0.964 . . . . 62.43 110.855 175.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.5 t -115.35 -15.63 11.54 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.397 -0.819 . . . . 73.04 108.823 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . 0.69 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.6 pm0 -76.52 -22.76 53.99 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.969 -1.014 . . . . 75.51 110.423 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.406 HG22 ' N ' ' B' ' 228' ' ' GLN . 10.0 mt -98.29 156.37 3.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.269 -0.423 . . . . 73.32 109.941 177.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.546 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 11.7 mt-30 -76.01 138.88 41.19 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.519 -0.548 . . . . 74.4 109.519 174.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 26.9 m -60.14 -29.72 68.83 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.218 0.532 . . . . 64.31 110.436 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.882 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -63.93 -26.8 70.45 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 115.62 -0.718 . . . . 43.32 113.048 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.546 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 34.5 mt-10 -72.8 -31.19 64.67 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 117.233 0.517 . . . . 72.55 110.468 -177.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 43.7 t -73.3 -36.9 50.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.355 0.597 . . . . 75.41 110.265 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 5.9 t -72.36 -37.75 68.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.957 -0.565 . . . . 54.3 109.73 177.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.36 -33.05 73.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.822 -0.627 . . . . 62.42 111.383 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 3.5 p -69.52 -28.79 66.34 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.795 0.331 . . . . 62.52 110.456 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.586 ' CD1' HD12 ' A' ' 14' ' ' LEU . 7.7 t80 -69.77 -37.07 76.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.536 0.684 . . . . 61.03 109.17 175.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.748 ' HG2' ' HB3' ' A' ' 73' ' ' TYR . 11.1 ttt -71.76 -52.91 15.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.451 -0.795 . . . . 62.11 111.251 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 14.1 t-105 -52.35 -39.9 61.28 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.49 -0.777 . . . . 75.01 111.061 175.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.525 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.43 -36.76 84.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.182 -0.463 . . . . 75.45 111.126 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 57.7 tp -65.82 -35.18 79.97 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.864 0.364 . . . . 64.34 110.33 179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.62 -49.77 73.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.06 -0.518 . . . . 64.43 110.781 178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -64.66 -33.59 76.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.099 -0.501 . . . . 72.14 110.84 179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -74.36 -39.55 62.69 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.947 -0.569 . . . . 73.43 111.021 -177.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.13 -24.1 51.69 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.936 0.347 . . . . 71.3 111.936 -178.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.403 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.19 -17.48 63.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.421 . . . . 71.32 111.089 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -59.0 -38.11 78.43 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.851 -0.613 . . . . 73.31 110.251 175.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -75.81 3.22 10.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.625 -0.716 . . . . 73.14 111.82 -177.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . 0.508 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -65.39 -35.01 90.88 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 119.983 -1.103 . . . . 72.44 110.438 171.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.923 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 78.9 p -77.66 -6.67 54.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.285 -0.458 . . . . 64.23 111.362 -177.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 62.4 p -109.38 -1.94 18.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.085 0.469 . . . . 70.14 110.408 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 24.0 t -81.44 -39.8 24.32 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.721 -0.672 . . . . 72.53 110.771 -175.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.68 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 1.7 m-85 -145.13 178.71 7.86 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.132 0.492 . . . . 73.43 112.075 -177.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.471 ' HG3' HG23 ' B' ' 254' ' ' THR . 13.5 pt-20 -104.5 -43.91 5.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.269 -0.878 . . . . 74.23 111.516 -172.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.471 HG23 ' HG3' ' B' ' 253' ' ' GLU . 45.7 p -104.77 149.4 25.66 Favored 'General case' 0 CA--C 1.509 -0.633 0 CA-C-N 116.523 -0.308 . . . . 64.41 110.287 -177.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.418 ' HB2' ' HE2' ' B' ' 255' ' ' LYS . 10.5 ptmm? -69.62 -26.83 64.62 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 120.846 0.355 . . . . 73.11 110.218 -179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -53.01 -51.35 61.94 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.64 -0.709 . . . . 71.53 110.579 174.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.599 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.0 mt-30 -83.7 -46.69 12.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.561 -0.745 . . . . 71.14 110.344 -178.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.923 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.6 ttt -56.35 -41.74 76.63 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.458 -0.792 . . . . 63.45 111.829 -175.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.63 ' HB2' HG21 ' A' ' 85' ' ' ILE . 28.7 tt0 -69.59 -36.41 76.2 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.673 0.273 . . . . 71.54 110.989 -177.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.68 -6.22 51.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.345 0.593 . . . . 55.42 110.495 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.68 ' HE3' ' CE2' ' B' ' 252' ' ' PHE . 70.6 mmtt -99.03 -2.33 37.48 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.531 -0.759 . . . . 71.15 110.944 -177.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.699 ' HG3' ' H ' ' B' ' 263' ' ' GLN . 11.6 ptpt -50.73 -50.77 54.67 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.853 -0.612 . . . . 71.2 110.546 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.699 ' H ' ' HG3' ' B' ' 262' ' ' LYS . 12.5 tp60 -79.47 -22.14 44.48 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 116.145 -0.48 . . . . 72.04 110.533 -176.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.55 -30.8 37.05 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.239 -0.437 . . . . 55.05 111.408 -178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.508 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 24.0 ptp -83.75 -31.49 25.94 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.648 -0.871 . . . . 70.21 108.648 177.072 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.49 ' CE ' ' HB3' ' A' ' 77' ' ' LEU . 59.2 mtp -82.64 -3.37 56.13 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.259 -0.882 . . . . 64.42 110.442 176.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.44 -42.73 98.67 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.132 -0.486 . . . . 74.25 110.629 -175.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.662 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 21.0 p90 -105.63 -9.04 17.58 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.865 -0.607 . . . . 70.12 111.079 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.439 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 3.5 m-30 -55.41 -51.13 67.89 Favored 'General case' 0 CA--C 1.517 -0.29 0 O-C-N 123.074 0.233 . . . . 72.42 110.785 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.545 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -50.44 -58.5 5.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.893 -0.594 . . . . 74.01 110.74 176.73 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . 0.471 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 19.6 t70 -87.2 63.69 7.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.658 -0.701 . . . . 72.42 111.108 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.662 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 4.9 mmp_? -121.97 -45.66 2.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.111 -0.495 . . . . 64.34 111.284 175.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.751 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -92.03 13.28 19.21 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.729 0.3 . . . . 74.04 110.515 -174.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.617 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.0 ttmt -59.3 -54.31 48.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.449 . . . . 53.11 110.84 -178.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -59.97 -41.56 92.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.397 -0.365 . . . . 64.52 111.41 179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 55.4 mtt -59.18 -47.97 83.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.385 0.612 . . . . 71.24 109.963 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.574 HD23 ' HE1' ' A' ' 70' ' ' MET . 41.5 tp -63.18 -36.65 84.34 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.875 -1.057 . . . . 74.5 110.504 -178.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . 0.402 ' N ' ' HE1' ' A' ' 66' ' ' MET . 9.1 t70 -63.71 -42.08 98.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.73 -0.668 . . . . 70.14 110.458 177.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -76.33 -14.99 60.07 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.649 -0.705 . . . . 42.21 111.324 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -94.85 -2.82 50.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.061 0.457 . . . . 74.24 110.72 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 19.0 mmt -89.49 179.77 5.99 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.883 -0.599 . . . . 73.44 110.684 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.704 ' HG2' HD12 ' B' ' 285' ' ' ILE . 42.1 mt-10 69.2 7.13 6.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.292 1.219 . . . . 63.45 114.292 166.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -64.78 -51.35 62.69 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.969 0.414 . . . . 72.33 110.297 175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -77.14 -23.61 51.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.262 -0.426 . . . . 75.34 110.477 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.704 HD12 ' HG2' ' B' ' 282' ' ' GLU . 68.5 mt -65.19 -53.19 43.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.936 -0.574 . . . . 70.35 110.862 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 11.3 pt-20 -67.49 -20.96 65.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.181 -0.463 . . . . 71.11 111.78 -178.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . 0.421 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 51.5 m-80 -106.54 5.59 29.3 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.778 0.288 . . . . 71.44 111.778 -177.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -56.88 -47.42 80.5 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.116 -0.234 . . . . 62.02 111.187 -177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.7 -25.26 66.28 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.149 -0.478 . . . . 71.1 111.013 -178.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -76.73 -54.9 6.02 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.952 -0.388 . . . . 71.12 109.952 176.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -59.44 -50.37 74.22 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.279 -0.419 . . . . 73.43 111.161 -179.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.487 ' O ' ' HD2' ' B' ' 292' ' ' ARG . 3.1 tmm_? -58.68 -29.48 66.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.412 -0.813 . . . . 74.33 110.215 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -81.17 -41.57 22.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.091 -0.504 . . . . 54.41 110.883 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 25.1 p -71.86 -18.34 62.07 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.184 0.439 . . . . 74.54 112.184 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -98.32 141.99 30.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.462 0.649 . . . . 71.3 110.939 -178.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 57.2 mttp . . . . . 0 C--O 1.248 0.991 0 CA-C-N 115.095 -0.957 . . . . 72.02 109.671 177.39 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.4 m . . . . . 0 N--CA 1.478 0.975 0 CA-C-O 120.595 0.236 . . . . 71.23 110.735 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -79.63 -33.82 41.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.919 0.39 . . . . 63.01 110.453 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 3.0 p-10 -150.7 120.53 7.08 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.018 -0.734 . . . . 74.34 109.018 172.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -78.79 -80.27 0.12 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.173 -0.467 . . . . 62.43 112.011 -171.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -98.78 -21.31 16.43 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.356 0.598 . . . . 60.02 110.768 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.68 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -133.16 -179.75 5.69 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.792 -0.64 . . . . 61.02 111.46 -173.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.445 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -83.67 46.13 1.13 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.334 -0.848 . . . . 65.03 111.871 -176.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.1 m-85 -55.42 -41.13 72.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.772 0.32 . . . . 65.01 111.55 -176.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.39 -13.41 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.444 . . . . 54.35 111.878 -178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.445 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 41.4 mmt180 -93.32 -60.34 1.81 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.765 -0.198 . . . . 73.04 110.627 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.789 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.31 -22.44 12.02 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.805 0.669 . . . . 73.12 112.805 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.592 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.7 t -68.37 -22.41 64.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.678 0.275 . . . . 71.25 110.768 -179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.495 ' HB2' HD11 ' B' ' 217' ' ' LEU . 41.3 mt-10 -81.04 -27.61 35.69 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 121.319 0.58 . . . . 74.43 109.631 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.789 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -70.36 -48.53 55.94 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.205 -0.907 . . . . 72.11 109.724 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.459 HG13 ' HB1' ' B' ' 239' ' ' ALA . 80.6 mt -66.53 -27.86 41.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 121.469 0.652 . . . . 64.33 109.91 175.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.592 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.1 OUTLIER -66.74 -29.07 68.95 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.448 -0.796 . . . . 64.14 110.743 -177.362 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.663 HD12 HD13 ' B' ' 214' ' ' LEU . 2.8 tm? -75.25 -36.67 61.25 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.329 -0.619 . . . . 71.45 109.329 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.16 -28.45 70.07 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.801 -0.636 . . . . 64.41 110.462 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -76.9 -19.27 57.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.941 -0.572 . . . . 72.22 110.263 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.588 HE21 ' HD2' ' A' ' 16' ' ' LYS . 76.0 mm-40 -73.02 -41.82 63.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.68 -0.691 . . . . 71.41 109.474 176.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -78.93 -19.88 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.31 -0.859 . . . . 70.03 110.034 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.41 -5.86 53.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.663 -0.699 . . . . 44.24 110.128 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -75.55 -9.77 58.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.24 -0.436 . . . . 74.2 110.607 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.48 HD22 HG13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -78.64 111.48 14.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.136 -0.484 . . . . 72.44 109.726 178.579 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.406 HG22 ' H ' ' A' ' 25' ' ' THR . 2.9 t -73.37 -27.28 61.39 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.809 -0.632 . . . . 61.45 112.018 -174.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.406 ' HG2' HD22 ' A' ' 24' ' ' ASN . 1.8 pm0 -87.26 -3.39 59.04 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.494 0.553 . . . . 64.22 112.494 -177.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.48 HG13 HD22 ' A' ' 24' ' ' ASN . 7.1 mt -107.45 149.51 10.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.806 -0.442 . . . . 65.53 109.806 177.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.08 145.06 32.63 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.16 -0.681 . . . . 72.1 109.16 177.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.491 HG22 ' HZ ' ' B' ' 247' ' ' PHE . 6.6 m -60.35 -25.11 65.59 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.203 0.525 . . . . 63.33 110.382 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -69.66 -15.74 71.3 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 115.691 -0.686 . . . . 73.21 112.884 179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -81.28 -31.94 33.45 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.367 -0.605 . . . . 74.24 109.367 176.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 39.8 t -72.36 -44.78 62.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.467 -0.788 . . . . 63.04 110.443 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.0 p -60.91 -39.37 89.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.181 0.515 . . . . 64.21 110.471 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.8 -31.56 72.27 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.632 -0.713 . . . . 74.31 110.788 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.414 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 51.6 m -67.96 -37.27 81.35 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.769 0.318 . . . . 75.31 110.159 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.566 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.1 t80 -68.24 -36.18 79.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.105 -0.702 . . . . 61.23 109.105 175.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.591 ' SD ' HD21 ' B' ' 240' ' ' LEU . 10.3 tpt -60.18 -60.75 3.32 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 114.919 -1.037 . . . . 73.22 110.974 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.486 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 30.7 t-105 -59.52 -33.68 71.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.477 -0.783 . . . . 64.35 111.428 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.401 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -66.0 -41.52 90.92 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.304 -0.407 . . . . 61.42 111.586 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.59 HD13 ' HB3' ' B' ' 236' ' ' PHE . 50.3 tp -67.35 -33.1 74.53 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.983 0.42 . . . . 74.54 110.482 -178.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.491 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -62.2 -40.12 95.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.999 -0.546 . . . . 22.12 110.839 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 42' ' ' ARG . 38.2 mtp85 -74.74 -34.8 62.6 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.804 -0.634 . . . . 72.12 110.823 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.518 ' HD2' HG23 ' B' ' 215' ' ' ILE . 9.9 t80 -76.53 -35.38 58.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.167 -0.469 . . . . 74.45 110.739 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-20 -75.1 -34.95 61.78 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 111.807 0.299 . . . . 74.34 111.807 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.521 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -68.47 -14.87 63.3 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.974 0.416 . . . . 75.5 111.361 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.7 t90 -58.11 -32.72 68.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.764 -0.653 . . . . 72.44 110.323 175.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.574 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 78.1 m-85 -80.38 -7.74 59.22 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.902 -0.59 . . . . 34.31 111.917 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.431 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -58.89 -34.93 80.47 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.452 -0.88 . . . . 64.4 111.779 178.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.1 t -72.79 -19.55 61.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.734 0.302 . . . . 71.51 111.087 -178.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 49.8 p -89.72 -14.21 35.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.783 0.325 . . . . 73.4 110.877 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.1 m -70.91 -32.49 69.44 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.258 -0.428 . . . . 75.15 111.951 -174.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -179.15 7.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.116 0.484 . . . . 62.22 111.537 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -99.77 -47.98 4.87 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.083 -0.962 . . . . 75.41 111.097 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.2 p -99.7 159.1 15.3 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.691 -0.231 . . . . 75.53 110.596 -178.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -68.1 -34.95 77.35 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.083 0.24 . . . . 72.13 111.14 -175.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.31 -47.49 82.02 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.972 0.415 . . . . 73.32 110.53 -178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.594 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -75.43 -32.73 60.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.924 -0.58 . . . . 54.34 110.314 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 16.1 ttt -66.26 -45.7 79.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.021 -0.536 . . . . 73.55 110.782 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.49 ' HB2' HG21 ' B' ' 285' ' ' ILE . 34.0 tt0 -67.15 -29.82 69.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.815 -0.63 . . . . 73.12 110.753 -179.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.84 -4.11 26.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.379 -0.373 . . . . 60.12 111.692 -179.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.594 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.3 mmmm -117.67 4.66 12.32 Favored 'General case' 0 CA--C 1.505 -0.766 0 CA-C-O 120.75 0.31 . . . . 64.5 110.491 -176.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 16.3 ptmt -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.9 -0.591 . . . . 72.33 110.736 -174.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.411 HE22 ' HE2' ' B' ' 274' ' ' LYS . 16.4 tp60 -68.75 -26.08 65.06 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.87 0.367 . . . . 75.12 110.559 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -70.76 -42.97 69.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.974 -0.557 . . . . 65.51 111.644 -176.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.546 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 2.8 ptt? -83.75 -27.08 29.15 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 120.17 -0.612 . . . . 63.3 109.782 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.641 ' HG2' HD22 ' B' ' 277' ' ' LEU . 75.7 mtp -78.47 -17.79 55.77 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.628 -0.715 . . . . 75.42 111.575 -178.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -66.44 -24.75 66.49 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 108.525 -0.917 . . . . 73.3 108.525 -179.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.536 ' HD2' ' CG ' ' A' ' 72' ' ' ARG . 34.7 m-85 -93.71 -32.96 13.82 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 114.414 -1.266 . . . . 74.01 111.199 178.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.434 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 23.1 m-85 -60.98 -45.13 96.01 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.204 -0.665 . . . . 71.05 109.204 175.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.48 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -67.04 -59.83 3.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.375 -0.375 . . . . 72.31 110.039 169.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -106.34 81.54 1.62 Allowed 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 113.189 0.811 . . . . 74.33 113.189 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.536 ' CG ' ' HD2' ' A' ' 68' ' ' TYR . 7.9 mmm180 -147.13 -31.16 0.33 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.731 -0.668 . . . . 72.23 109.757 164.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.629 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -93.08 10.87 29.74 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 109.309 -0.626 . . . . 71.32 109.309 178.148 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -66.36 -56.32 11.67 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.271 -0.877 . . . . 55.23 110.076 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -59.62 -36.81 77.06 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.477 -0.329 . . . . 64.41 110.925 177.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.0 mtt -62.67 -41.08 98.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.238 0.542 . . . . 74.01 110.05 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.547 HD22 ' HG2' ' B' ' 266' ' ' MET . 1.2 tt -71.89 -42.11 67.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.486 -0.779 . . . . 43.31 110.144 -176.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -58.74 -39.85 82.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.26 0.553 . . . . 54.21 109.948 175.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.45 -21.22 66.62 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.324 -0.853 . . . . 72.13 111.365 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -93.36 -24.04 18.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 70.44 110.25 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.406 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 25.4 mmt -63.2 -45.59 91.0 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.523 -0.917 . . . . 71.33 108.523 169.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.497 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 43.4 mm-40 -68.21 12.63 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.24 -0.891 . . . . 75.23 111.916 176.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -93.01 -55.5 3.32 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.902 -0.777 . . . . 54.42 108.902 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -84.77 -33.16 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.785 -0.643 . . . . 71.34 111.808 -177.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 76.7 mt -62.3 -57.39 12.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.491 0.186 . . . . 73.03 111.433 -177.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.7 pt-20 -69.18 -15.74 63.47 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.125 0.417 . . . . 42.21 112.125 -175.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -109.13 10.3 25.99 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.998 -0.281 . . . . 75.12 110.942 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.516 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 71.5 t80 -57.87 -47.93 81.3 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.451 -0.34 . . . . 72.3 111.106 -177.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.72 -27.72 69.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.384 -0.371 . . . . 65.03 110.443 -177.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -69.76 -51.83 30.61 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.696 -0.483 . . . . 74.41 109.696 177.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.56 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 73.1 m-85 -61.47 -44.99 96.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.297 0.57 . . . . 74.23 110.432 176.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.464 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 3.7 tmm_? -62.03 -22.63 65.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.415 -0.811 . . . . 73.3 110.128 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -82.45 -26.17 32.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.018 -0.537 . . . . 74.52 111.083 -178.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.5 p -90.37 -9.27 48.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.264 -0.426 . . . . 64.11 111.381 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.56 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 26.1 mt-30 -84.9 155.59 21.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.095 0.474 . . . . 71.32 111.038 -178.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 97.7 mttt . . . . . 0 C--N 1.323 -0.559 0 CA-C-N 115.358 -0.837 . . . . 75.51 110.291 179.689 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.351 0.596 . . . . 54.43 110.274 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . 0.415 ' HB3' ' HB2' ' B' ' 209' ' ' ALA . 16.2 m120 -93.3 -11.14 33.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.632 -0.713 . . . . 72.33 110.127 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.757 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 0.5 OUTLIER -157.95 146.36 18.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.725 -0.67 . . . . 73.42 109.822 177.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -91.05 -75.85 0.46 Allowed 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.095 -0.706 . . . . 52.32 109.095 178.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -115.5 -37.38 4.02 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.52 -0.919 . . . . 73.15 108.52 170.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.757 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -93.99 150.97 19.88 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.162 -0.926 . . . . 73.05 111.764 178.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.468 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -71.68 57.89 0.3 Allowed 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 125.064 1.346 . . . . 63.32 113.146 -179.639 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -51.67 -43.06 62.57 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.479 0.548 . . . . 71.22 112.479 -177.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . 0.415 ' HB2' ' HB3' ' B' ' 202' ' ' ASN . . . -62.25 -27.76 69.23 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.946 0.721 . . . . 74.35 112.946 -174.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' B' ' 210' ' ' ARG . 19.5 mmt180 -87.66 -56.49 3.33 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.939 -0.304 . . . . 62.41 111.642 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.601 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -51.75 -25.73 8.1 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.689 0.626 . . . . 73.13 112.689 -179.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 6.2 t -69.32 -23.63 63.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 121.336 -0.146 . . . . 52.34 111.357 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -81.71 -27.87 33.7 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.1 -0.704 . . . . 72.31 109.1 -178.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.663 HD13 HD12 ' A' ' 17' ' ' LEU . 3.4 mm? -67.08 -51.78 50.13 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.78 -1.1 . . . . 73.31 109.467 177.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.518 HG23 ' HD2' ' A' ' 43' ' ' TYR . 78.1 mt -63.67 -30.37 49.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.515 -0.766 . . . . 75.54 110.227 176.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.497 ' O ' ' HB2' ' B' ' 219' ' ' ASN . 0.0 OUTLIER -59.62 -36.98 77.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.8 -0.636 . . . . 70.23 110.82 -177.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.603 ' HA ' ' NE2' ' B' ' 220' ' ' GLN . 3.0 tm? -67.61 -40.01 84.74 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.128 -0.693 . . . . 71.4 109.128 178.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.45 -22.16 66.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.716 -0.675 . . . . 72.35 110.707 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.562 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -66.28 -42.06 88.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.781 -0.645 . . . . 74.15 110.488 176.928 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . 0.603 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -61.78 -43.85 98.04 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.834 0.349 . . . . 74.43 111.158 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -70.16 -21.6 63.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.201 0.524 . . . . 73.21 110.379 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.51 -13.38 59.59 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.687 -0.688 . . . . 74.54 109.891 177.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.562 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 20.3 mm-40 -83.77 -2.07 55.55 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.318 -0.401 . . . . 74.51 110.218 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.561 HD22 HG13 ' B' ' 227' ' ' ILE . 1.4 t30 -81.46 103.26 11.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.114 -0.698 . . . . 71.23 109.114 178.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.1 t -59.25 -28.77 67.01 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 113.412 0.893 . . . . 74.04 113.412 -171.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -87.22 -0.29 56.48 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.931 0.345 . . . . 74.33 111.931 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.561 HG13 HD22 ' B' ' 224' ' ' ASN . 5.7 mt -112.24 149.49 14.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.866 -0.42 . . . . 64.55 109.866 177.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.471 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 0.3 OUTLIER -88.81 151.41 22.4 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.308 -0.627 . . . . 74.04 109.308 178.723 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.8 m -57.51 -30.83 65.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.262 0.554 . . . . 64.21 110.202 177.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.574 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -70.8 -16.14 74.22 Favored Glycine 0 N--CA 1.451 -0.347 0 CA-C-N 115.461 -0.79 . . . . 71.45 113.645 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.471 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 7.7 mm-40 -87.79 -24.98 23.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.552 0.676 . . . . 64.54 109.642 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 23.3 t -75.13 -40.4 44.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.398 -0.819 . . . . 73.03 110.242 179.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.7 p -63.15 -39.04 93.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.202 0.525 . . . . 72.14 110.271 177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.9 -32.99 74.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.751 -0.659 . . . . 64.33 110.837 178.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 46.8 m -66.73 -37.37 84.53 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 121.105 0.478 . . . . 61.02 110.101 178.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.59 ' HB3' HD13 ' A' ' 40' ' ' LEU . 4.4 t80 -67.76 -35.67 79.13 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.794 -0.639 . . . . 73.34 109.696 177.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.629 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.3 ttm -67.06 -50.26 62.44 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.685 -0.689 . . . . 51.11 111.489 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.0 t-105 -59.49 -38.79 81.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.073 0.463 . . . . 63.44 110.728 178.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.459 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.09 -41.07 91.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.01 -0.541 . . . . 74.44 111.443 -179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.591 HD21 ' SD ' ' A' ' 37' ' ' MET . 53.1 tp -65.67 -33.71 76.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.893 0.378 . . . . 55.21 110.557 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.2 -40.53 97.74 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.066 -0.515 . . . . 55.25 110.773 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 69.8 mtp85 -70.7 -42.15 71.03 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.061 -0.518 . . . . 72.31 110.604 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -70.6 -37.96 73.94 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.79 -0.641 . . . . 72.41 111.179 -174.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 52.5 m-20 -71.83 -34.79 69.6 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.964 0.357 . . . . 52.3 111.964 -178.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -65.74 -25.69 67.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 64.5 111.153 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 15.0 t90 -59.56 -33.84 71.93 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.637 -0.71 . . . . 74.33 110.113 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.491 ' HZ ' HG22 ' A' ' 29' ' ' THR . 71.5 m-85 -83.68 -8.71 59.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.31 -0.405 . . . . 73.21 111.33 -178.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . 0.515 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -73.56 -30.94 61.38 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.23 -0.986 . . . . 64.24 110.661 171.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 34.9 t -70.12 -12.25 61.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.299 -0.451 . . . . 62.24 111.141 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.1 t -113.61 14.07 18.82 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.041 0.448 . . . . 72.11 110.27 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 29.0 t -88.95 -35.65 16.33 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.163 -0.472 . . . . 71.01 110.641 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.507 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.5 OUTLIER -137.95 174.01 11.02 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.761 0.315 . . . . 75.02 111.579 178.895 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -92.87 -30.61 15.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.773 -0.649 . . . . 72.43 112.325 -170.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.2 p -120.58 156.12 32.27 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.811 -0.177 . . . . 65.43 110.63 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.516 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 12.6 ptmm? -64.33 -29.11 70.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 72.53 110.37 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . 0.49 ' OE2' ' HG3' ' B' ' 255' ' ' LYS . 19.9 mm-40 -63.4 -57.58 9.85 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.767 -0.651 . . . . 75.43 110.651 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.697 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 22.2 mt-30 -68.94 -39.09 79.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.968 -0.56 . . . . 74.41 110.651 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 10.2 ttt -60.41 -44.08 96.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.285 -0.416 . . . . 75.1 110.883 179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' B' ' 262' ' ' LYS . 7.8 tt0 -62.79 -35.78 80.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.089 0.471 . . . . 74.55 110.835 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -74.07 -5.81 43.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.006 -0.543 . . . . 64.23 111.094 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.697 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 14.3 mmmm -114.3 6.79 16.24 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.509 -0.314 . . . . 74.24 110.448 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.569 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 17.8 ptpt -56.95 -53.2 60.75 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 120.678 -0.409 . . . . 70.43 110.226 -177.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.556 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 15.0 tp60 -72.45 -22.01 61.15 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.847 -0.427 . . . . 72.14 109.847 -177.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -69.91 -42.44 73.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.6 -0.727 . . . . 65.4 111.299 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.569 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 2.6 ptt? -88.13 -27.7 21.74 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.211 0.529 . . . . 73.1 109.97 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.547 ' HG2' HD22 ' A' ' 77' ' ' LEU . 80.6 mtp -74.58 -17.51 60.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.684 -0.689 . . . . 75.34 110.611 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -62.37 -30.12 70.96 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.92 -0.77 . . . . 73.35 108.92 177.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.567 ' HD2' ' HG3' ' B' ' 272' ' ' ARG . 44.7 m-85 -86.7 -35.38 19.3 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.483 -1.235 . . . . 55.45 111.157 178.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.53 ' HA ' ' HE1' ' A' ' 37' ' ' MET . 22.6 m-30 -61.09 -44.29 97.59 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.485 -0.561 . . . . 73.23 109.485 177.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.431 ' HE3' ' N ' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.55 -57.3 5.38 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.352 -0.539 . . . . 73.01 109.679 171.256 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . 0.516 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 7.0 t70 -108.53 81.42 1.47 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.657 0.614 . . . . 74.23 112.657 -172.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.567 ' HG3' ' HD2' ' B' ' 268' ' ' TYR . 5.8 mmm180 -156.81 -26.81 0.09 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.945 -0.57 . . . . 73.15 110.029 166.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.405 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -95.27 9.32 40.22 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.469 -0.937 . . . . 74.54 108.469 174.191 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.437 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 62.1 tttm -64.29 -59.32 4.53 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.248 -1.342 . . . . 61.21 110.356 177.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -55.3 -38.86 69.2 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.086 -0.506 . . . . 54.53 111.013 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . 0.486 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 50.2 mtt -60.63 -40.99 93.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.447 0.641 . . . . 73.43 110.412 177.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.641 HD22 ' HG2' ' A' ' 66' ' ' MET . 0.9 OUTLIER -75.01 -41.34 59.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.283 -0.871 . . . . 74.43 110.274 -178.006 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -57.87 -44.53 86.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 74.01 110.242 178.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.4 -28.47 69.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.127 -0.942 . . . . 44.23 111.748 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -83.57 -21.49 32.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.9 0.381 . . . . 74.4 110.528 -178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.521 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 24.3 mmt -68.26 -52.97 27.92 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.038 -0.528 . . . . 72.43 110.14 175.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.688 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 40.1 mm-40 -51.08 -37.56 46.43 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.319 -0.855 . . . . 73.1 112.338 -177.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -50.0 -42.75 49.75 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-O 120.697 0.284 . . . . 62.13 111.676 -178.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -86.86 -32.16 20.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.857 0.36 . . . . 74.01 110.595 -178.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.49 HG21 ' HB2' ' A' ' 59' ' ' GLN . 70.5 mt -66.28 -55.31 19.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.935 -0.575 . . . . 74.14 111.521 -177.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.688 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -75.08 -6.58 50.25 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.761 0.315 . . . . 72.43 111.758 -175.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -116.37 12.37 15.25 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.328 -0.396 . . . . 75.53 110.857 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -53.0 -49.23 66.61 Favored 'General case' 0 N--CA 1.463 0.184 0 O-C-N 123.192 0.307 . . . . 71.33 111.037 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -57.32 -35.14 69.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.862 -0.608 . . . . 72.11 111.134 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -70.91 -50.86 30.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.274 -0.421 . . . . 65.32 109.975 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . 0.609 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 65.2 m-85 -57.84 -50.77 72.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.993 -0.549 . . . . 73.54 110.758 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.9 -22.16 62.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.281 0.562 . . . . 73.22 110.421 -178.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -82.56 -36.24 26.44 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.017 -0.538 . . . . 54.41 110.752 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 18.0 p -85.25 -17.99 35.32 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.997 -0.547 . . . . 73.14 111.652 -179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.609 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 25.5 mt-30 -84.63 163.87 19.01 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.251 0.548 . . . . 61.13 110.858 -179.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 92.1 mttt . . . . . 0 C--O 1.249 1.074 0 CA-C-N 115.224 -0.898 . . . . 63.55 109.133 179.574 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.475 0.823 0 N-CA-C 110.366 -0.235 . . . . 73.1 110.366 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -93.52 15.03 16.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.647 0.737 . . . . 43.11 109.294 178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.5 p-10 -158.79 152.91 23.72 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.305 -0.861 . . . . 75.34 109.612 -178.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -81.77 -81.66 0.14 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.762 0.315 . . . . 71.3 110.967 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -111.16 -33.13 6.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.899 0.381 . . . . 72.24 110.875 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.46 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -104.76 159.64 15.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.081 0.467 . . . . 72.52 111.363 -177.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.1 OUTLIER -76.78 53.66 0.93 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.164 -0.925 . . . . 74.54 112.481 -177.531 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.425 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 37.8 m-85 -54.39 -38.99 66.81 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 120.862 0.363 . . . . 71.11 111.253 -178.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.44 -14.36 60.76 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.814 -0.63 . . . . 74.31 112.207 -176.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.616 ' NH1' ' HB3' ' B' ' 231' ' ' GLU . 64.5 mtt180 -93.5 -59.98 1.88 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.051 -0.352 . . . . 74.43 110.051 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.511 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.83 -25.94 21.92 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.766 -0.652 . . . . 60.41 112.657 -177.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 13.5 t -63.95 -22.9 67.13 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 120.634 0.254 . . . . 61.23 111.296 -178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.546 ' HB2' HD11 ' B' ' 217' ' ' LEU . 32.9 mt-10 -90.98 -32.25 16.02 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 120.913 0.387 . . . . 74.35 109.969 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.614 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.6 mm? -61.92 -45.96 91.44 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.157 -0.683 . . . . 63.24 109.157 176.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.598 HG23 ' HD2' ' B' ' 243' ' ' TYR . 92.3 mt -66.86 -28.42 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.404 -0.817 . . . . 64.31 110.399 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' A' ' 12' ' ' THR . 0.2 OUTLIER -68.49 -29.91 68.63 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.857 -0.61 . . . . 70.44 110.575 -177.101 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.489 HD12 HD13 ' B' ' 214' ' ' LEU . 2.2 tm? -69.86 -44.63 69.45 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.69 -0.856 . . . . 75.23 108.69 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.85 -33.1 74.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.374 -0.83 . . . . 64.44 109.965 178.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 5.4 t-20 -57.23 -38.7 74.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.221 -0.9 . . . . 52.15 110.396 177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -67.01 -42.17 85.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.776 -0.647 . . . . 63.21 111.368 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 82.2 mt-30 -74.26 -20.32 60.19 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.053 0.454 . . . . 74.14 110.53 -177.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -88.04 0.21 56.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.981 -0.554 . . . . 55.24 110.68 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.584 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.9 mm-40 -80.77 55.23 2.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.868 0.366 . . . . 62.42 110.467 177.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.511 ' ND2' HG13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -144.62 142.48 30.17 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.217 -0.447 . . . . 51.53 109.873 -177.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.5 t -93.18 -43.36 8.89 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.291 0.478 . . . . 53.12 112.291 -176.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -73.7 -24.75 59.98 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.382 0.512 . . . . 75.45 112.382 -177.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.511 HG13 ' ND2' ' A' ' 24' ' ' ASN . 5.6 mt -83.76 143.98 10.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.296 -0.631 . . . . 71.43 109.296 177.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.655 ' HG2' ' HG2' ' A' ' 31' ' ' GLU . 9.7 pt20 -83.42 150.68 25.9 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.997 -0.547 . . . . 53.53 110.017 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.0 m -56.37 -33.28 65.55 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.657 -0.702 . . . . 73.02 111.375 -175.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.586 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -63.14 -26.53 69.33 Favored Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.945 -0.57 . . . . 42.44 113.997 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.655 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 51.8 mm-40 -62.97 -28.43 70.08 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 117.318 0.559 . . . . 72.4 111.172 -176.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.67 -46.78 15.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.084 -0.507 . . . . 73.51 110.825 -176.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.4 m -55.7 -40.11 71.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.999 -0.546 . . . . 63.13 110.983 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.82 -30.78 68.37 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.14 -0.482 . . . . 64.3 111.229 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 62.5 m -66.9 -32.08 73.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 74.42 110.107 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.614 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.5 t80 -68.45 -33.11 73.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.872 -0.604 . . . . 74.41 109.854 178.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.568 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.5 ttm -68.09 -49.72 59.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.692 -0.686 . . . . 74.51 111.407 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.477 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 29.3 t-105 -62.02 -37.59 85.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.076 0.465 . . . . 73.25 110.669 178.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.42 -34.32 76.98 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.128 -0.487 . . . . 54.34 111.264 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 47.4 tp -65.64 -35.71 81.58 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-O 120.942 0.401 . . . . 74.23 110.029 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.524 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -62.11 -54.18 44.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.876 -0.602 . . . . 73.04 110.985 179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 -61.9 -32.82 73.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.644 -0.253 . . . . 74.1 111.602 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.403 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 11.1 t80 -77.4 -39.33 47.49 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.972 -0.291 . . . . 72.41 110.917 -177.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -70.31 -35.41 73.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.953 0.406 . . . . 75.15 110.806 178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -69.54 -11.53 60.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.125 -0.488 . . . . 73.24 111.129 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.403 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 19.2 t90 -74.19 -15.28 61.02 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.444 0.64 . . . . 73.1 109.833 176.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -97.8 -0.93 44.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.998 0.428 . . . . 75.2 111.142 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -74.94 -29.84 60.26 Favored Glycine 0 N--CA 1.443 -0.841 0 C-N-CA 120.47 -0.872 . . . . 74.44 111.009 176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 1.024 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 7.0 p -73.15 -5.37 38.72 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.754 0.311 . . . . 73.3 111.826 -177.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 15.2 t -120.19 14.01 12.11 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.0 0.428 . . . . 63.02 110.372 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -76.66 -54.93 5.99 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.163 -0.471 . . . . 54.04 111.884 -178.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.687 ' HE2' ' HE2' ' A' ' 61' ' ' LYS . 3.0 m-85 -128.87 173.55 10.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.034 0.445 . . . . 74.11 112.076 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.517 ' HG3' HG23 ' A' ' 54' ' ' THR . 12.1 pt-20 -88.51 -36.08 16.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.28 -0.873 . . . . 73.45 111.459 -172.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.517 HG23 ' HG3' ' A' ' 53' ' ' GLU . 62.9 p -119.85 151.53 38.72 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 116.105 -0.498 . . . . 74.54 110.283 -178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.577 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 21.2 ptmt -68.6 -25.07 64.68 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.652 -0.499 . . . . 54.23 109.652 176.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -55.2 -40.39 70.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.579 -0.737 . . . . 71.53 110.468 176.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.681 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 15.2 mt-30 -93.84 -43.32 8.65 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.623 -0.717 . . . . 64.03 110.311 178.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 1.024 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 24.5 ttt -58.11 -40.64 81.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.642 -0.708 . . . . 71.12 111.904 -175.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.738 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.8 tt0 -64.38 -41.92 96.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.814 0.34 . . . . 54.13 110.633 -179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.56 -18.29 64.31 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.097 -0.502 . . . . 64.44 111.164 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.687 ' HE2' ' HE2' ' A' ' 52' ' ' PHE . 32.3 mmmt -91.28 0.35 57.54 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.11 -0.495 . . . . 70.02 110.54 -175.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.41 ' HG2' ' N ' ' A' ' 63' ' ' GLN . 1.5 ptmm? -55.15 -43.05 73.88 Favored 'General case' 0 C--O 1.221 -0.415 0 N-CA-C 109.829 -0.434 . . . . 64.23 109.829 -177.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.41 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 11.1 tp60 -82.76 -19.61 37.52 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.278 -0.419 . . . . 64.45 110.521 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -87.17 -30.5 20.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.028 -0.533 . . . . 73.1 111.584 -175.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.3 ptp -82.02 -27.52 33.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.189 -1.041 . . . . 73.24 108.189 177.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 77.8 mtp -85.97 -10.02 55.85 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.899 -1.046 . . . . 73.12 110.429 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -53.05 -43.55 66.72 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.724 -0.671 . . . . 72.5 111.791 -173.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.57 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 6.6 p90 -109.69 -1.53 17.98 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.159 -0.473 . . . . 73.35 111.215 -175.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.677 ' HD2' HD21 ' B' ' 277' ' ' LEU . 4.2 m-30 -63.0 -46.99 85.04 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.52 0.2 . . . . 73.53 110.759 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.478 ' HE1' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.1 -46.22 72.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.415 0.626 . . . . 65.03 110.042 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -89.65 14.07 12.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.089 -0.959 . . . . 75.41 112.172 -168.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.736 ' NE ' ' HA ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -86.08 -43.05 13.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 O-C-N 121.584 -0.697 . . . . 73.32 111.443 -172.065 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.685 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -98.68 15.29 25.68 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.389 -0.524 . . . . 55.54 110.212 -178.347 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.589 ' HE3' ' HG2' ' B' ' 270' ' ' MET . 32.8 ttmt -62.86 -52.92 61.26 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.705 -0.68 . . . . 72.13 109.576 176.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.429 ' H ' ' HG2' ' A' ' 75' ' ' GLU . 6.4 pt-20 -57.49 -41.41 80.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.137 -0.938 . . . . 73.4 111.135 177.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 59.1 mtt -61.16 -47.32 86.76 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.262 0.554 . . . . 73.2 110.592 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.591 HD13 ' HE1' ' B' ' 270' ' ' MET . 1.0 OUTLIER -69.66 -36.09 75.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.245 -0.889 . . . . 72.43 110.63 -174.551 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.46 ' N ' ' HE1' ' B' ' 266' ' ' MET . 19.2 t70 -61.12 -31.2 70.91 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.237 0.542 . . . . 51.22 110.532 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -82.59 -6.9 59.61 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.602 -0.726 . . . . 72.34 111.524 -178.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -105.46 -16.57 14.69 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.057 0.456 . . . . 75.41 110.662 -179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.446 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 20.9 mmt -75.97 -179.15 4.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.797 -0.638 . . . . 73.24 111.415 177.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.603 ' HA ' ' CG1' ' A' ' 85' ' ' ILE . 40.5 mt-10 67.8 8.74 6.63 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 114.878 -1.055 . . . . 64.01 113.718 171.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.29 -55.26 35.59 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.145 0.497 . . . . 74.13 110.648 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -85.24 -10.23 56.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.95 -0.568 . . . . 70.44 111.012 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.603 ' CG1' ' HA ' ' A' ' 82' ' ' GLU . 59.2 mt -76.0 -57.33 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 CA-C-O 120.757 0.313 . . . . 74.43 110.744 -178.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.0 pt-20 -66.8 -25.56 66.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.735 0.302 . . . . 74.12 110.872 -177.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -99.0 7.26 46.17 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.337 -0.392 . . . . 65.15 111.304 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.404 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 77.8 t80 -60.02 -39.34 85.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.708 0.289 . . . . 73.24 110.466 -179.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -54.95 -38.95 68.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.324 0.583 . . . . 70.14 110.478 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -68.6 -48.87 63.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.509 -0.769 . . . . 71.42 110.168 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -64.7 -32.17 73.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.928 0.394 . . . . 72.12 111.205 179.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -13.36 61.66 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.522 0.677 . . . . 64.43 110.094 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -97.28 -41.47 8.25 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.569 -0.741 . . . . 35.35 110.545 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 40.3 p -92.07 18.09 8.51 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.187 -0.46 . . . . 72.23 111.592 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -61.21 152.43 28.87 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.217 0.532 . . . . 72.51 111.072 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.404 ' NZ ' ' HB2' ' A' ' 96' ' ' LYS . 8.0 mtmp? . . . . . 0 C--N 1.32 -0.712 0 CA-C-N 115.753 -0.658 . . . . 73.43 110.963 -173.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 21.2 m . . . . . 0 C--O 1.234 0.255 0 CA-C-O 120.98 0.419 . . . . 71.45 110.722 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -85.16 11.54 9.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.718 0.77 . . . . 72.23 109.8 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.692 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.4 OUTLIER -149.76 154.16 38.03 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.027 -0.988 . . . . 74.11 108.805 176.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.14 -79.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.799 0.333 . . . . 75.04 111.502 -176.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -117.41 -56.32 2.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.1 0.476 . . . . 63.13 110.112 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -71.28 160.39 32.89 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 115.757 -0.656 . . . . 61.55 110.642 179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.477 ' HE1' ' CB ' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -76.62 52.26 0.8 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.598 -0.728 . . . . 73.23 112.251 -176.587 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.692 ' HD2' ' HB2' ' B' ' 203' ' ' ASN . 55.8 m-85 -55.62 -37.51 68.27 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.965 0.412 . . . . 73.35 111.179 -178.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -70.49 -20.6 62.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.02 -0.537 . . . . 74.1 111.689 -176.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.41 ' NH1' ' HB3' ' A' ' 31' ' ' GLU . 79.4 mtt180 -91.6 -60.6 1.84 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.83 0.348 . . . . 73.13 110.228 -177.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.78 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -56.7 -22.88 38.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.715 -0.675 . . . . 72.12 112.669 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -65.97 -24.82 66.87 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 120.591 0.234 . . . . 71.32 110.741 -178.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 38.8 mt-10 -83.04 -25.94 31.64 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.423 0.63 . . . . 62.14 109.865 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.59 -42.84 91.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.351 -0.84 . . . . 70.23 109.512 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 79.6 mt -68.58 -26.53 33.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.629 -0.714 . . . . 62.22 110.221 176.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.513 ' HB2' ' O ' ' B' ' 213' ' ' GLU . 10.6 mmmm -60.73 -42.27 96.98 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.056 -0.52 . . . . 75.24 111.66 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.576 HD12 HD13 ' A' ' 14' ' ' LEU . 2.6 tm? -64.33 -31.89 73.28 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.164 -0.68 . . . . 63.02 109.164 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -72.28 -37.55 68.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.777 -0.647 . . . . 74.33 109.979 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.644 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.2 m-20 -61.0 -34.28 74.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.844 -0.616 . . . . 72.53 110.689 176.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -69.07 -38.37 79.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.296 -0.411 . . . . 72.34 111.572 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -76.61 -22.61 53.93 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.348 0.594 . . . . 73.22 110.198 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -78.99 -13.28 59.89 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.261 -0.882 . . . . 70.5 110.714 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 84.8 mm-40 -72.3 -7.36 49.06 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 112.336 0.495 . . . . 74.11 112.336 -176.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.737 HD22 HG13 ' B' ' 227' ' ' ILE . 9.5 t30 -71.43 166.8 20.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.816 0.341 . . . . 72.54 110.194 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.6 t -116.48 3.01 13.19 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 120.772 0.32 . . . . 63.32 111.43 -173.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -128.93 7.08 5.53 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.023 0.379 . . . . 74.1 112.023 176.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.737 HG13 HD22 ' B' ' 224' ' ' ASN . 4.5 mt -109.9 144.45 18.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 C-N-CA 120.284 -0.566 . . . . 75.22 110.118 177.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 17.2 mp0 -79.4 142.26 36.13 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.162 -0.927 . . . . 71.05 109.066 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 39.3 m -60.2 -27.64 67.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.063 0.459 . . . . 75.41 110.649 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.85 -15.42 76.01 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.912 -0.585 . . . . 74.42 112.843 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.616 ' HB3' ' NH1' ' A' ' 10' ' ' ARG . 68.1 mm-40 -78.25 -18.22 55.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 117.194 0.497 . . . . 74.12 110.467 179.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.3 -38.25 10.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.669 -0.696 . . . . 75.04 110.497 -178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.1 p -64.4 -38.77 92.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.236 0.541 . . . . 71.4 110.347 178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.12 -37.47 85.81 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.776 -0.647 . . . . 55.21 111.103 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.49 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 2.3 p -71.65 -26.41 62.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 120.97 -0.292 . . . . 54.55 110.748 -179.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.549 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 6.9 t80 -70.28 -40.63 74.21 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.088 -0.708 . . . . 72.53 109.088 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.685 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.7 ttm -65.79 -47.87 73.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.48 -0.782 . . . . 74.44 111.344 178.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 18.1 t-105 -60.92 -38.42 85.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.995 0.426 . . . . 74.35 110.701 177.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.465 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -66.2 -33.15 75.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.159 -0.473 . . . . 63.42 111.449 -178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.584 HD13 ' HB3' ' A' ' 36' ' ' PHE . 49.3 tp -70.05 -34.95 73.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.976 0.417 . . . . 70.42 109.891 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.48 -48.86 77.75 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.788 -0.642 . . . . 75.33 110.821 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -77.95 -14.9 59.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 63.31 111.028 -175.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.598 ' HD2' HG23 ' A' ' 15' ' ' ILE . 28.0 t80 -89.13 -48.91 7.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.222 0.534 . . . . 70.45 110.349 178.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -78.58 -16.38 57.48 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.846 -0.615 . . . . 73.15 112.015 -170.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -66.99 -15.42 63.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.147 0.499 . . . . 61.32 111.008 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.4 t90 -56.96 -31.74 65.33 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.443 -0.799 . . . . 64.32 111.506 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.586 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 67.9 m-85 -73.5 -11.64 60.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.316 -0.402 . . . . 73.21 112.0 -175.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -61.49 -38.42 95.76 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.15 -1.024 . . . . 65.52 111.384 176.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.917 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 13.1 m -66.85 -13.17 61.31 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.057 0.392 . . . . 51.2 112.057 -175.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.8 t -116.81 18.29 14.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.072 0.463 . . . . 53.54 110.582 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 30.2 t -83.48 -49.24 9.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.282 -0.417 . . . . 75.24 111.568 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 1.6 m-85 -139.5 -179.45 5.9 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.653 0.612 . . . . 74.25 112.653 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.599 ' HG3' HG23 ' B' ' 254' ' ' THR . 15.5 pt-20 -92.13 -36.41 13.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.836 -1.074 . . . . 75.12 112.043 -171.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.599 HG23 ' HG3' ' B' ' 253' ' ' GLU . 69.8 p -123.17 154.92 38.03 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 116.328 -0.396 . . . . 72.11 110.181 -176.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.404 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 22.7 ptmt -65.04 -29.78 70.71 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.154 0.284 . . . . 71.43 110.72 -178.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -59.0 -53.03 63.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.281 0.562 . . . . 75.35 110.849 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.637 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.8 mt-30 -78.54 -35.3 46.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.663 -0.699 . . . . 71.43 110.361 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.917 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 25.6 ttt -64.26 -42.86 96.27 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.895 -0.593 . . . . 72.15 111.105 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -67.45 -35.48 79.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.344 -0.389 . . . . 75.24 110.887 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.6 2.9 7.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.925 0.393 . . . . 70.54 111.459 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.637 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.7 mmmt -114.65 -0.16 13.71 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 109.895 -0.409 . . . . 73.14 109.895 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.458 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 9.9 ptmt -55.22 -52.17 64.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.84 -0.618 . . . . 61.15 110.942 -173.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.458 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.5 tp60 -76.72 -26.05 54.23 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 109.985 -0.376 . . . . 71.24 109.985 -177.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -75.05 -34.13 61.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.05 -0.523 . . . . 75.34 111.633 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 22.0 ptp -81.49 -29.26 33.73 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 108.372 -0.973 . . . . 75.41 108.372 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.478 ' HG2' HD22 ' A' ' 77' ' ' LEU . 68.0 mtp -80.86 -19.17 45.11 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.914 -1.039 . . . . 71.41 111.253 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -68.64 -27.32 65.9 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-O 122.079 0.942 . . . . 73.55 108.5 -175.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -99.94 8.8 43.81 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 114.216 -1.356 . . . . 71.22 111.277 178.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.4 m-30 -97.05 -45.93 6.38 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 106.951 -1.5 . . . . 74.31 106.951 165.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.591 ' HE1' HD13 ' A' ' 77' ' ' LEU . 0.0 OUTLIER -59.69 -66.05 0.58 Allowed 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.407 -0.815 . . . . 73.52 110.53 170.486 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . 0.575 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 4.8 t70 -102.03 76.5 1.61 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.101 0.408 . . . . 73.21 112.101 -171.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.575 ' HG2' ' O ' ' B' ' 271' ' ' ASP . 1.8 mmp_? -152.23 -28.92 0.16 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.491 -0.322 . . . . 72.12 111.383 170.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.568 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.62 1.44 42.27 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.525 -0.917 . . . . 74.23 108.525 174.613 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -58.48 -49.32 77.76 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 114.485 -1.234 . . . . 64.12 110.692 179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -61.75 -42.65 99.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 73.12 110.866 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 54.3 mtt -61.55 -47.65 84.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.625 -0.716 . . . . 73.0 109.676 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.677 HD21 ' HD2' ' A' ' 69' ' ' TYR . 34.3 tp -59.9 -42.86 94.77 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.644 -1.162 . . . . 52.44 111.165 -175.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.94 -43.13 99.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.196 0.522 . . . . 73.21 110.14 178.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.04 -20.75 60.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.391 -0.822 . . . . 53.04 111.525 -179.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -87.95 -9.51 53.35 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.912 0.387 . . . . 74.3 110.634 -179.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.428 ' HG2' ' HB1' ' A' ' 45' ' ' ALA . 58.3 mtt -93.35 -169.23 2.08 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.104 -0.498 . . . . 75.32 111.07 177.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.782 ' HG2' HD12 ' B' ' 285' ' ' ILE . 38.4 mt-10 69.47 13.93 8.36 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.899 -1.046 . . . . 75.32 112.311 177.075 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.6 p-10 -65.48 -47.03 77.46 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.958 0.409 . . . . 71.5 110.073 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . 0.459 ' O ' ' HB2' ' B' ' 288' ' ' PHE . 4.3 m-85 -89.45 -5.44 57.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.508 -0.315 . . . . 72.43 111.006 174.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.782 HD12 ' HG2' ' B' ' 282' ' ' GLU . 60.8 mt -79.54 -59.79 2.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 110.138 -0.319 . . . . 60.4 110.138 178.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 3.1 pt-20 -65.56 -27.89 68.76 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.867 0.365 . . . . 45.11 110.701 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 65.3 m-80 -98.52 7.09 46.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.426 -0.352 . . . . 75.04 111.054 -178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.459 ' HB2' ' O ' ' B' ' 284' ' ' TYR . 76.9 t80 -64.35 -37.54 87.87 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.93 -0.767 . . . . 71.13 108.93 174.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -53.27 -32.16 47.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.414 -0.812 . . . . 72.33 110.252 173.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -78.47 -56.16 4.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.297 -0.865 . . . . 71.33 110.021 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -62.3 -39.26 92.41 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.231 -0.44 . . . . 75.21 111.91 -176.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.416 ' HD3' ' OE1' ' B' ' 295' ' ' GLN . 17.3 tpp180 -66.22 -19.05 65.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.122 0.487 . . . . 73.4 110.339 177.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -96.73 -23.01 16.63 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.283 -0.417 . . . . 61.23 111.504 -177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.9 p -111.12 18.68 19.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.13 0.49 . . . . 72.4 111.066 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.416 ' OE1' ' HD3' ' B' ' 292' ' ' ARG . 18.1 pt20 -69.25 160.44 31.19 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.77 -0.65 . . . . 72.41 111.11 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? . . . . . 0 C--N 1.318 -0.803 0 CA-C-N 115.251 -0.886 . . . . 74.41 109.166 177.469 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 34.3 m . . . . . 0 N--CA 1.479 0.982 0 CA-C-O 120.592 0.234 . . . . 73.42 110.383 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 56.53 52.67 9.51 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.709 -0.678 . . . . 74.33 111.29 177.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.63 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.9 p-10 -157.52 132.68 8.87 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.973 -0.558 . . . . 71.03 110.769 178.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.79 -72.35 0.17 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.583 -0.735 . . . . 72.4 111.111 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -120.63 -57.59 1.89 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.196 -0.456 . . . . 74.22 109.822 -179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.63 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.29 161.94 28.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.871 -0.604 . . . . 75.14 110.981 176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.53 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -79.72 54.85 1.9 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.384 -0.826 . . . . 62.34 111.948 -179.078 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 33.0 m-85 -52.14 -45.29 64.94 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.379 -0.373 . . . . 73.14 111.962 -175.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.54 -10.57 58.67 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 112.441 0.534 . . . . 64.24 112.441 -174.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.463 ' HD2' ' HB2' ' A' ' 7' ' ' PHE . 95.5 mtt180 -91.33 -62.07 1.52 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.901 -0.407 . . . . 54.31 109.901 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.773 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.28 -25.03 31.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.772 0.656 . . . . 71.32 112.772 -178.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.438 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 15.1 t -64.73 -20.81 66.55 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 121.147 -0.221 . . . . 75.03 111.321 -179.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HB2' HD11 ' B' ' 217' ' ' LEU . 39.7 mt-10 -86.22 -30.81 22.09 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.423 -0.584 . . . . 73.5 109.423 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.68 -47.08 82.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.168 -0.924 . . . . 75.33 109.021 174.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.46 HG13 ' HB1' ' B' ' 239' ' ' ALA . 72.3 mt -67.16 -29.87 47.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.483 -0.781 . . . . 73.4 110.389 175.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 12' ' ' THR . 1.2 tmmt? -64.02 -32.31 73.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.15 -0.477 . . . . 62.15 110.475 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 17' ' ' LEU . 1.6 tm? -69.33 -43.88 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.997 -0.742 . . . . 75.53 108.997 177.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.1 -37.8 84.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.947 -0.569 . . . . 71.54 110.694 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.529 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 8.0 m-80 -59.4 -32.89 70.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.842 -0.617 . . . . 73.41 110.944 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -73.88 -31.82 63.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 60.11 111.53 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -84.73 -22.33 29.74 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.827 0.346 . . . . 72.21 111.023 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -83.6 -0.48 50.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.275 0.56 . . . . 62.45 110.088 178.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 84.2 mm-40 -75.69 -13.69 60.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.116 -0.493 . . . . 73.23 109.814 173.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.647 HD22 HG13 ' A' ' 27' ' ' ILE . 2.0 t30 -69.2 114.98 7.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.513 -0.767 . . . . 72.01 109.681 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 2.9 t -62.65 -34.54 77.29 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.405 0.891 . . . . 70.03 113.405 -170.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.0 pm0 -90.96 1.19 57.24 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.42 -0.512 . . . . 73.43 112.175 -176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.647 HG13 HD22 ' A' ' 24' ' ' ASN . 7.6 mt -104.09 149.46 7.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.423 0.63 . . . . 75.14 110.158 177.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.545 ' CG ' ' HG3' ' A' ' 31' ' ' GLU . 16.8 pt20 -90.46 155.74 18.7 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 115.104 -0.953 . . . . 74.32 109.143 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.3 m -60.73 -21.51 63.04 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.478 0.656 . . . . 65.44 110.259 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.45 ' HA2' ' CZ ' ' B' ' 247' ' ' PHE . . . -67.15 -39.85 92.63 Favored Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.38 -0.827 . . . . 73.33 113.283 179.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.545 ' HG3' ' CG ' ' A' ' 28' ' ' GLN . 42.8 mt-10 -67.85 -32.03 72.27 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 117.488 0.644 . . . . 75.24 110.317 -174.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -72.68 -41.37 62.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.565 -0.743 . . . . 74.33 110.385 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.0 t -61.83 -44.73 96.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.211 0.529 . . . . 72.41 110.277 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -63.24 -32.55 73.98 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.867 -0.606 . . . . 62.02 111.031 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.53 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 48.8 m -66.0 -37.95 87.23 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 121.046 0.45 . . . . 61.33 109.905 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.649 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.6 t80 -63.77 -40.01 95.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.731 -0.668 . . . . 53.53 109.774 177.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.76 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.9 ttm -66.47 -46.19 77.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.609 -0.723 . . . . 65.54 111.831 179.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.453 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 19.9 t-105 -63.08 -36.94 85.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 74.13 110.947 178.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.497 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -66.44 -37.89 86.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.094 -0.503 . . . . 74.52 111.493 -179.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.588 HD13 ' HB3' ' B' ' 236' ' ' PHE . 44.4 tp -69.98 -28.45 65.54 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.013 0.435 . . . . 72.4 110.375 -178.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.561 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -63.16 -42.26 99.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.948 -0.569 . . . . 73.34 111.0 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -77.41 -28.91 52.81 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.923 0.392 . . . . 72.33 110.574 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -76.7 -35.13 58.07 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.124 -0.489 . . . . 74.43 110.574 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -77.92 -32.17 51.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.308 -0.405 . . . . 73.11 112.048 -178.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.89 -20.65 66.3 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.266 0.555 . . . . 51.44 110.708 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -60.13 -33.56 72.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.265 -0.879 . . . . 72.53 111.078 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.459 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.9 m-85 -77.92 -3.49 42.07 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 116.154 -0.475 . . . . 75.24 112.156 -174.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.51 -27.48 70.94 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.163 -1.018 . . . . 72.21 110.748 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.774 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 3.7 m -65.32 -18.1 65.04 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.13 -0.535 . . . . 72.35 111.833 -177.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.6 t -114.69 20.33 15.34 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-O 121.056 0.455 . . . . 71.4 110.88 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -83.48 -59.51 2.42 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.375 -0.375 . . . . 72.02 111.586 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.698 ' CD1' ' HG3' ' A' ' 61' ' ' LYS . 4.8 m-85 -134.86 175.32 9.67 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.106 0.41 . . . . 64.22 112.106 -175.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.527 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.0 pt-20 -82.37 -40.29 21.53 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 115.707 -0.678 . . . . 75.45 111.854 -170.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.527 HG23 ' HG3' ' A' ' 53' ' ' GLU . 80.6 p -119.65 155.48 32.25 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 109.865 -0.42 . . . . 43.11 109.865 -178.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.5 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 12.1 ptmm? -67.44 -26.41 66.39 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.581 -0.448 . . . . 72.12 110.418 -176.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.0 -26.83 65.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.188 -0.46 . . . . 55.11 111.038 -177.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.734 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 17.8 mt-30 -97.21 -43.54 7.31 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.521 -0.548 . . . . 73.34 109.521 175.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.774 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 11.2 ttt -55.31 -44.21 75.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.169 -0.923 . . . . 55.03 111.721 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.427 ' O ' ' HE2' ' A' ' 62' ' ' LYS . 47.5 tt0 -63.9 -42.42 97.44 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.077 -0.511 . . . . 65.51 110.827 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.71 -2.85 18.86 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.028 -0.533 . . . . 75.52 111.712 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.734 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 73.4 mmtt -104.1 1.05 30.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.422 -0.354 . . . . 52.14 110.826 -178.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.528 ' O ' ' HG3' ' A' ' 66' ' ' MET . 0.0 OUTLIER -52.93 -46.01 67.92 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 123.209 0.318 . . . . 74.4 110.809 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.471 ' N ' ' HG2' ' A' ' 62' ' ' LYS . 9.1 tp60 -77.91 -27.96 49.64 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.045 0.45 . . . . 74.02 110.014 -174.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -74.17 -29.38 61.74 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.892 -0.594 . . . . 72.32 111.176 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.462 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 21.6 ptp -86.1 -28.08 24.27 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 109.488 -0.56 . . . . 74.44 109.488 177.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.637 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 86.2 mtp -75.34 -18.14 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.548 -0.751 . . . . 73.14 111.313 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -63.0 -31.85 73.08 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.861 0.839 . . . . 51.41 109.465 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.44 ' HD2' ' CD ' ' A' ' 72' ' ' ARG . 85.9 m-85 -93.73 -4.34 50.6 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.639 -1.164 . . . . 73.35 111.155 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.637 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 22.8 m-30 -86.49 -53.87 4.74 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.014 -1.106 . . . . 74.42 108.014 170.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.53 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -58.96 -65.43 0.67 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.999 -0.546 . . . . 64.23 111.602 175.553 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.568 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 0.1 OUTLIER -98.77 24.2 7.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 114.861 1.43 . . . . 74.23 114.861 -159.807 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.44 ' CD ' ' HD2' ' A' ' 68' ' ' TYR . 1.2 mmp_? -112.96 -19.92 11.74 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.388 -0.925 . . . . 51.52 112.997 -179.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.664 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -88.78 5.01 45.53 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.745 -0.835 . . . . 73.13 108.745 173.251 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -61.57 -57.75 10.83 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.414 -1.266 . . . . 74.03 110.519 -177.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.34 -33.68 76.06 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.183 -0.462 . . . . 70.21 111.708 -178.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.496 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 44.6 mtm -74.35 -23.29 59.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.276 0.56 . . . . 50.45 110.16 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.557 HD22 ' HG2' ' B' ' 266' ' ' MET . 3.4 tt -76.68 -35.29 58.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.566 -0.743 . . . . 71.22 109.209 176.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.457 ' N ' ' HE1' ' B' ' 266' ' ' MET . 25.2 t70 -59.6 -37.21 77.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.054 -0.976 . . . . 55.11 111.213 -178.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.37 -19.5 63.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.8 -0.636 . . . . 64.31 112.095 -178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -100.24 -3.51 31.32 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 74.32 111.852 -176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.489 ' CE ' ' HA ' ' B' ' 245' ' ' ALA . 24.1 mmt -85.51 -176.26 6.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.696 0.284 . . . . 74.43 110.534 175.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.756 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 63.0 -10.46 0.1 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 114.027 1.121 . . . . 74.02 114.027 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -56.17 -65.37 0.61 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 121.039 0.447 . . . . 63.52 111.381 -176.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -72.91 -13.38 61.25 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.29 -0.414 . . . . 72.23 110.905 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.756 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.6 mt -76.89 -54.32 13.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.431 . . . . 72.43 110.83 -176.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.61 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.2 pt-20 -68.7 -22.37 64.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.982 0.42 . . . . 73.22 111.106 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.2 m-80 -98.57 3.34 48.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.291 -0.413 . . . . 74.22 110.878 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 73.3 t80 -64.73 -37.42 87.55 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.733 -0.212 . . . . 75.41 110.491 -177.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -52.29 -42.28 63.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.584 0.707 . . . . 74.22 109.76 174.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -70.55 -44.96 66.37 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.935 -1.03 . . . . 70.11 110.849 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.556 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 57.4 m-85 -62.18 -40.08 94.84 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.234 0.54 . . . . 62.15 110.521 178.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.536 ' HD3' ' HA ' ' A' ' 92' ' ' ARG . 0.5 OUTLIER -61.35 -22.97 65.42 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.818 -0.628 . . . . 75.01 111.901 176.003 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -84.8 -27.6 26.72 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.113 -0.494 . . . . 63.41 111.354 -175.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 17.9 p -97.11 1.92 50.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.21 0.528 . . . . 75.31 111.285 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 48.4 mt-30 -95.24 -175.44 3.5 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.875 -0.602 . . . . 74.24 110.925 177.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt . . . . . 0 C--N 1.322 -0.62 0 CA-C-N 115.66 -0.7 . . . . 54.13 110.545 -174.759 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 38.6 m . . . . . 0 N--CA 1.454 -0.228 0 CA-C-O 121.105 0.478 . . . . 65.12 110.555 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -82.65 97.14 8.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.912 -0.585 . . . . 51.11 110.629 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.72 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 2.8 p-10 -166.25 130.44 2.15 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.023 0.439 . . . . 64.14 109.913 177.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -77.02 -76.18 0.18 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.995 -0.548 . . . . 55.42 110.891 -177.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -106.75 -45.31 4.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.472 0.653 . . . . 72.22 109.863 -178.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.72 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -102.18 169.33 8.79 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 73.14 111.173 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.53 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -83.77 54.25 2.82 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 123.833 0.853 . . . . 75.14 112.063 -177.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.536 ' CE1' ' HB3' ' B' ' 206' ' ' ALA . 29.1 m-85 -53.81 -43.54 69.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.158 -0.474 . . . . 71.13 112.086 -175.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -71.34 -5.83 35.44 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.628 0.603 . . . . 43.24 112.628 -175.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -98.97 -59.97 1.62 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.906 -0.405 . . . . 73.24 109.906 178.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.909 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -59.35 -18.52 39.15 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 112.845 0.683 . . . . 63.12 112.845 -178.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.8 t -66.95 -19.62 65.75 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 121.131 -0.228 . . . . 61.44 111.094 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.407 ' HB2' HD11 ' A' ' 17' ' ' LEU . 33.4 mt-10 -86.67 -26.62 24.22 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.189 0.519 . . . . 73.23 109.894 178.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.909 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.45 -47.87 74.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.406 -0.815 . . . . 72.34 109.547 178.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.483 HG13 ' HB1' ' A' ' 39' ' ' ALA . 76.5 mt -66.3 -30.17 49.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.801 -0.636 . . . . 65.43 110.127 175.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.413 ' HE3' ' HB3' ' B' ' 216' ' ' LYS . 1.1 tmmt? -64.06 -31.85 73.19 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.575 -0.739 . . . . 71.12 111.204 -178.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.668 HD12 HD13 ' A' ' 14' ' ' LEU . 2.8 tm? -67.86 -42.0 81.99 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.664 -0.865 . . . . 71.32 108.664 176.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.19 -35.8 76.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.677 -0.692 . . . . 60.13 110.719 178.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.434 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -63.2 -25.54 68.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.052 -0.522 . . . . 72.21 111.347 179.24 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.52 -36.26 29.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.45 -0.341 . . . . 71.11 111.304 179.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 74.3 mt-30 -74.77 -22.82 58.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.276 0.56 . . . . 61.44 110.354 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -72.65 -17.05 61.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.176 -0.92 . . . . 63.12 110.084 177.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 78.5 mm-40 -77.32 74.83 3.88 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.071 -0.513 . . . . 73.54 110.623 179.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.992 HD22 HG13 ' B' ' 227' ' ' ILE . 26.4 t30 -151.15 176.8 10.83 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.567 -0.901 . . . . 74.11 108.567 174.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.8 t -111.82 -37.94 4.99 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.397 -0.521 . . . . 74.33 112.082 -176.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -83.32 -28.02 29.35 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.171 0.434 . . . . 71.14 112.171 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.992 HG13 HD22 ' B' ' 224' ' ' ASN . 5.7 mt -76.87 151.01 5.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 72.52 110.257 -178.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.603 ' HG2' ' HG2' ' B' ' 231' ' ' GLU . 13.8 pm0 -101.96 157.05 17.14 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.872 -0.604 . . . . 73.41 109.487 173.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 17.8 m -58.18 -23.93 57.2 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.173 0.511 . . . . 63.14 110.86 -179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.459 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.84 -35.39 91.85 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.588 -0.733 . . . . 51.42 113.199 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.603 ' HG2' ' HG2' ' B' ' 228' ' ' GLN . 14.9 mm-40 -70.16 -24.84 63.22 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 117.276 0.538 . . . . 64.22 110.342 -175.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.24 -41.47 22.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.737 -0.665 . . . . 74.32 110.289 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.0 t -62.11 -43.71 98.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.043 -0.526 . . . . 64.24 110.297 -179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -63.7 -33.02 74.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.961 -0.563 . . . . 64.42 110.983 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.411 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 50.4 m -65.54 -38.41 89.56 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.013 0.435 . . . . 54.51 110.084 179.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.596 ' CD1' HD12 ' A' ' 14' ' ' LEU . 4.4 t80 -65.24 -36.53 84.43 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.587 0.708 . . . . 75.44 109.501 176.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.664 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 7.0 ttm -66.41 -49.39 66.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.287 -0.87 . . . . 74.34 111.949 179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.53 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 21.6 t-105 -62.92 -37.82 88.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.343 . . . . 71.54 110.732 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.572 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.89 -36.87 85.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.176 -0.465 . . . . 55.33 111.304 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 54.5 tp -67.76 -33.65 75.26 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 121.046 0.45 . . . . 64.12 110.166 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.547 ' HB1' ' HA ' ' A' ' 77' ' ' LEU . . . -60.99 -48.17 83.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.741 -0.663 . . . . 72.13 110.988 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -67.87 -34.78 77.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.331 -0.395 . . . . 74.12 111.08 -178.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -74.14 -38.01 63.89 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.074 -0.512 . . . . 74.44 110.726 -176.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -75.2 -28.39 59.98 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.659 0.244 . . . . 71.14 111.659 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.489 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -70.37 -15.6 62.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.286 0.565 . . . . 53.1 110.809 178.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -67.05 -33.99 76.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.451 -0.795 . . . . 75.0 110.561 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.45 ' CZ ' ' HA2' ' A' ' 30' ' ' GLY . 76.8 m-85 -78.68 -0.74 31.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.947 -0.57 . . . . 72.03 112.044 -176.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . 0.533 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.93 -36.33 72.85 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.42 -0.895 . . . . 72.14 111.235 175.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.804 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 5.1 m -68.37 -11.83 60.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.469 -0.365 . . . . 53.33 111.611 -178.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 27.1 p -105.85 1.77 27.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.964 0.411 . . . . 72.01 110.59 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 32.0 t -77.98 -43.2 30.32 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.952 -0.567 . . . . 55.23 111.198 -175.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.503 ' HD1' ' HG2' ' B' ' 253' ' ' GLU . 0.3 OUTLIER -144.0 -179.71 6.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.36 0.6 . . . . 63.5 112.561 -174.08 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.503 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 7.1 pt-20 -94.49 -47.53 6.51 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.74 -1.118 . . . . 74.34 111.872 -172.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 74.3 p -111.91 156.49 21.98 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 109.538 -0.541 . . . . 72.24 109.538 -178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.3 ptmt -68.02 -31.89 71.88 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 120.422 -0.511 . . . . 64.34 110.701 -177.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -65.98 -37.1 85.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.941 0.4 . . . . 52.51 111.044 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.523 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 26.1 mt-30 -90.55 -14.8 31.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.281 -0.418 . . . . 74.11 110.828 179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.804 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 17.9 ttt -89.06 -40.17 13.14 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.942 -0.572 . . . . 74.11 110.541 -179.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.488 ' O ' ' HD2' ' B' ' 262' ' ' LYS . 32.8 tt0 -63.02 -34.52 77.75 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.643 -0.708 . . . . 73.45 110.802 179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.68 -3.63 19.47 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.352 -0.386 . . . . 71.34 110.709 178.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 73.3 mmtt -115.62 -9.65 11.96 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.323 -0.398 . . . . 61.32 112.055 -176.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.664 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 0.0 OUTLIER -64.5 -27.07 68.73 Favored 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 120.021 -0.671 . . . . 71.54 110.73 -173.133 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -83.36 -41.12 18.55 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 110.108 -0.33 . . . . 75.32 110.108 173.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -62.59 -42.42 99.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 75.5 111.836 -177.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.664 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 24.3 ptp -68.25 -29.84 68.75 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 109.085 -0.709 . . . . 71.42 109.085 -177.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.557 ' HG2' HD22 ' A' ' 77' ' ' LEU . 52.5 mtp -75.86 -36.31 59.61 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.161 -0.927 . . . . 72.33 110.92 178.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -62.53 -31.76 72.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 75.52 111.001 -165.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.683 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 17.6 p90 -97.02 -11.98 23.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.222 -0.445 . . . . 71.34 110.984 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.415 ' HD1' ' HA ' ' B' ' 269' ' ' TYR . 2.5 m-30 -60.48 -47.66 85.18 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 110.135 -0.32 . . . . 51.33 110.135 177.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.568 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -49.68 -45.73 49.08 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 115.672 -0.694 . . . . 70.34 110.231 174.135 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -92.1 26.06 2.64 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.86 -1.064 . . . . 65.52 111.698 -169.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.683 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 3.6 mmp_? -97.87 -46.79 5.81 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 121.729 -0.607 . . . . 65.11 111.455 -177.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.76 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -89.64 10.78 21.88 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.329 -0.548 . . . . 74.43 110.547 -178.575 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.441 ' HE3' ' HG2' ' A' ' 70' ' ' MET . 29.4 ttmt -60.32 -53.94 51.59 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.702 -0.681 . . . . 74.21 110.454 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -61.52 -40.88 96.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.922 -0.581 . . . . 71.32 111.492 -176.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 60.5 mtm -73.74 -29.78 62.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.799 0.333 . . . . 52.14 110.663 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 4.8 tt -72.6 -43.68 63.01 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.507 -0.553 . . . . 75.11 109.507 177.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.54 -27.86 69.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.815 -0.63 . . . . 72.43 110.821 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -80.99 -14.4 57.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.95 -0.568 . . . . 52.2 111.548 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -95.39 -8.36 35.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.227 0.536 . . . . 74.1 110.274 178.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 20.6 mmt -73.74 178.06 5.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.619 -0.719 . . . . 75.31 111.226 176.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.748 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 40.4 mt-10 70.09 -5.22 1.34 Allowed 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 113.998 1.111 . . . . 63.35 113.998 171.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.28 -68.5 0.34 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.116 0.417 . . . . 73.42 110.586 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 99.1 m-85 -60.4 -28.72 68.46 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.848 0.356 . . . . 71.35 110.832 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.748 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 61.9 mt -64.53 -55.04 23.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.96 -0.564 . . . . 71.12 111.628 -176.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.7 pt-20 -63.12 -25.95 68.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.907 0.384 . . . . 75.03 111.29 -177.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -97.27 5.62 49.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.191 -0.459 . . . . 65.43 111.196 -178.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -54.99 -52.85 61.83 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.648 0.24 . . . . 64.25 111.648 -176.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -62.76 -25.85 68.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.638 0.256 . . . . 65.5 111.249 -177.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -66.83 -56.22 11.36 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.411 -0.588 . . . . 55.31 109.411 175.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . 0.678 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 34.7 m-85 -65.83 -35.1 79.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.143 -0.48 . . . . 74.32 111.287 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.887 ' HA ' HE21 ' B' ' 295' ' ' GLN . 8.1 tmm_? -66.29 -22.96 66.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.08 -0.509 . . . . 73.51 110.119 178.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -87.14 -32.41 19.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.055 -0.52 . . . . 75.34 110.782 179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 23.4 p -84.18 -6.3 59.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.143 -0.48 . . . . 75.32 111.407 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.887 HE21 ' HA ' ' B' ' 292' ' ' ARG . 42.5 mt-30 -74.61 161.19 29.94 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.471 0.653 . . . . 43.32 111.012 175.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . 0.716 ' HE2' ' HA ' ' B' ' 296' ' ' LYS . 9.8 mmpt? . . . . . 0 C--O 1.25 1.093 0 CA-C-N 114.84 -1.073 . . . . 65.12 109.307 -177.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.846 0.355 . . . . 74.12 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -76.02 -39.74 55.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.262 0.553 . . . . 74.32 110.155 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -127.94 126.6 41.77 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.704 -0.68 . . . . 72.14 110.075 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -81.94 99.88 9.34 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.148 -0.478 . . . . 54.15 110.607 -177.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 72.59 -60.77 0.52 Allowed 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.333 -0.848 . . . . 72.2 111.537 176.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.1 154.55 29.28 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.892 -0.595 . . . . 34.05 111.65 -176.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.513 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -79.13 51.24 1.14 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.961 -1.018 . . . . 63.53 112.608 -175.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.6 m-85 -54.03 -41.22 67.8 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.854 0.359 . . . . 72.04 111.154 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -4.77 34.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.021 -0.536 . . . . 35.43 112.361 -177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.46 ' NH2' ' HB3' ' B' ' 221' ' ' GLN . 60.7 mtp85 -99.86 -61.1 1.41 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.214 -0.291 . . . . 72.14 110.214 177.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.874 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.43 -22.49 12.73 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.77 0.656 . . . . 73.22 112.77 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.4 t -63.18 -22.71 67.05 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 120.706 0.289 . . . . 71.11 111.153 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.51 ' HB2' HD11 ' B' ' 217' ' ' LEU . 74.6 mt-10 -90.39 -28.08 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.075 0.464 . . . . 74.44 110.004 -178.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.874 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.8 mm? -62.39 -42.62 99.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.642 -0.708 . . . . 65.41 110.097 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.01 -23.21 21.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.506 -0.77 . . . . 73.03 111.093 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -64.22 -28.98 70.11 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 116.15 -0.477 . . . . 74.15 111.065 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 213' ' ' GLU . 2.1 tm? -74.52 -43.23 56.83 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.438 -0.579 . . . . 63.22 109.438 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.63 -40.28 75.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.965 -0.562 . . . . 62.44 111.416 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -66.45 -18.38 65.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.431 -0.349 . . . . 65.02 111.768 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.24 -23.63 51.29 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.431 0.634 . . . . 72.42 109.864 177.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -99.23 -11.91 20.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.733 -0.667 . . . . 73.04 110.07 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.859 ' HA ' HG21 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -86.57 -21.44 26.86 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.495 -0.775 . . . . 63.34 110.064 -177.792 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -80.67 18.94 0.87 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.185 -0.462 . . . . 74.33 111.998 -178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.566 HD22 HG13 ' A' ' 27' ' ' ILE . 1.7 t30 -82.74 107.2 15.19 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 108.121 -1.066 . . . . 63.43 108.121 174.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -59.64 -32.38 70.38 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.807 0.669 . . . . 63.01 112.807 -171.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -91.44 11.77 22.83 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.768 0.655 . . . . 73.34 112.768 -177.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.566 HG13 HD22 ' A' ' 24' ' ' ASN . 4.2 mt -120.52 152.07 23.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.022 0.439 . . . . 65.22 110.7 176.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.677 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 47.0 mt-30 -73.65 152.9 40.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.74 -0.664 . . . . 73.34 110.143 178.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.616 HG23 HD21 ' A' ' 22' ' ' ASN . 13.5 m -65.25 -34.15 77.67 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.206 0.527 . . . . 74.43 110.841 -179.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -77.1 -2.43 78.19 Favored Glycine 0 CA--C 1.52 0.386 0 CA-C-N 115.954 -0.566 . . . . 74.15 113.708 -176.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.677 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 52.5 mm-40 -86.47 -12.03 50.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.502 0.651 . . . . 54.34 110.246 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.859 HG21 ' HA ' ' A' ' 22' ' ' ASN . 21.3 t -91.74 -36.88 8.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.793 -0.64 . . . . 73.24 111.181 -176.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.9 p -58.65 -31.39 68.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 62.03 110.955 179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.09 -35.11 79.63 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 115.796 -0.638 . . . . 62.43 111.274 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.8 m -66.65 -36.38 82.42 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 121.123 0.487 . . . . 63.31 110.051 -178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.564 ' CD1' HD12 ' B' ' 214' ' ' LEU . 8.6 t80 -67.86 -35.54 78.72 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.761 -0.654 . . . . 62.12 109.509 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.597 ' HG2' ' HB3' ' B' ' 273' ' ' TYR . 11.5 ttt -66.48 -55.83 13.75 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.368 -0.833 . . . . 73.45 111.644 -178.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.62 ' CZ3' ' HB3' ' B' ' 276' ' ' MET . 16.7 t-105 -55.2 -41.1 71.53 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.283 -0.417 . . . . 73.3 111.142 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.454 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -60.72 -36.64 79.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.244 -0.434 . . . . 61.13 111.059 178.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.718 HD21 ' SD ' ' B' ' 237' ' ' MET . 55.9 tp -69.69 -35.97 75.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.05 0.452 . . . . 72.35 110.271 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.68 -49.92 75.57 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.774 -0.648 . . . . 32.11 111.306 -179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -80.21 -9.77 59.73 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.51 -0.476 . . . . 70.31 111.297 -176.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 8.2 t80 -86.25 -39.49 16.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.402 -0.592 . . . . 75.3 109.402 175.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -72.81 -30.5 64.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 75.22 111.116 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.608 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -72.37 -17.06 61.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 72.22 111.104 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 87.3 t90 -56.14 -38.19 70.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.846 -0.616 . . . . 72.45 110.373 177.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.553 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 69.7 m-85 -76.17 -11.31 59.9 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.734 -0.666 . . . . 72.22 112.072 -177.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.43 -33.55 85.07 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.394 -0.908 . . . . 63.04 111.484 177.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.712 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 60.2 p -60.76 -37.86 83.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.98 0.419 . . . . 71.21 111.493 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.6 t -95.07 13.98 23.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.149 0.5 . . . . 51.35 110.842 -175.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.1 t -76.36 -39.26 54.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 75.01 111.728 -175.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.664 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -140.07 -167.67 2.36 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.481 -0.487 . . . . 73.02 112.258 -176.418 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.65 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 9.0 pt-20 -104.59 -40.33 6.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.373 -0.831 . . . . 54.41 111.686 -174.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 72.5 p -118.02 162.64 17.83 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.877 -0.416 . . . . 70.22 109.877 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.61 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 18.4 ptmt -71.66 -35.33 70.32 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.642 -0.423 . . . . 72.04 110.797 -177.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -64.93 -42.84 94.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.31 -0.405 . . . . 72.22 111.118 -178.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.548 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.3 mt-30 -77.18 -36.1 55.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.886 0.374 . . . . 73.34 110.36 178.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.712 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 15.9 ttt -63.25 -40.28 96.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.046 -0.525 . . . . 71.13 110.687 177.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.522 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.2 tt0 -62.11 -33.74 75.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.713 -0.676 . . . . 63.12 111.053 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -79.51 -1.61 38.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.353 -0.385 . . . . 53.24 111.421 -178.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.664 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.9 mmmt -108.77 -0.38 19.98 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.408 -0.36 . . . . 71.43 111.413 -179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.624 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 14.0 ptpt -57.51 -50.81 71.86 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 123.3 0.375 . . . . 72.33 110.535 -176.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.624 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -75.43 -14.17 60.43 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.428 -0.351 . . . . 75.52 110.623 -176.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -82.73 -44.86 15.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.435 -0.348 . . . . 73.5 111.431 -178.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.537 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 3.9 ptt? -79.75 -22.49 43.17 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 119.914 -0.714 . . . . 73.14 109.617 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.475 ' HG2' HD22 ' B' ' 277' ' ' LEU . 56.9 mtp -89.44 -7.9 54.11 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.589 -0.732 . . . . 71.33 110.587 177.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -57.68 -45.47 85.56 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.166 0.508 . . . . 72.24 110.808 -175.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.657 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 7.1 p90 -110.52 6.06 21.71 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 115.377 -0.829 . . . . 74.31 110.333 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.559 ' O ' ' HE1' ' B' ' 237' ' ' MET . 0.8 OUTLIER -63.16 -53.67 49.7 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.217 -0.66 . . . . 71.55 109.217 173.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.473 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -55.88 -45.2 78.63 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.092 -0.706 . . . . 74.33 109.092 174.228 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.412 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 7.5 t70 -96.84 57.08 1.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.852 -1.067 . . . . 61.31 110.93 -173.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 7.8 mmm180 -122.29 -46.57 2.17 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-O 120.999 0.428 . . . . 73.31 110.648 172.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.774 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -92.25 12.56 21.98 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.49 0.662 . . . . 70.02 109.455 -178.529 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.564 ' HG3' ' SD ' ' B' ' 270' ' ' MET . 65.0 tttt -60.63 -63.82 1.17 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.463 -1.244 . . . . 72.14 110.658 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -61.27 -37.4 83.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.057 -0.52 . . . . 62.12 111.289 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.478 ' HB3' ' CZ3' ' B' ' 238' ' ' TRP . 47.3 mtm -69.05 -31.5 70.32 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.973 0.416 . . . . 74.21 110.407 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.538 HD22 ' HG2' ' B' ' 266' ' ' MET . 5.6 tt -73.56 -42.14 62.04 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.549 -0.537 . . . . 61.35 109.549 177.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.619 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 23.1 t70 -61.53 -35.27 77.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.818 -0.628 . . . . 64.11 110.329 177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.32 -13.72 62.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.444 -0.798 . . . . 53.35 111.523 177.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -100.61 -21.38 15.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.071 0.462 . . . . 64.51 109.759 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.521 ' O ' HG13 ' A' ' 85' ' ' ILE . 20.8 mmt -68.21 -55.73 11.22 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.832 -0.622 . . . . 71.22 110.18 174.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 12.5 pt-20 -57.29 -26.06 60.25 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 115.556 -0.747 . . . . 75.1 111.278 -178.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -53.04 -48.49 67.6 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.042 0.448 . . . . 73.53 110.409 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -84.15 -25.01 29.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.152 -0.476 . . . . 71.5 110.721 -179.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 81' ' ' MET . 67.5 mt -69.47 -56.87 10.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.277 -0.419 . . . . 74.25 110.919 -179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.632 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.1 pt-20 -68.96 -19.74 64.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.807 0.337 . . . . 53.04 111.163 -176.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -103.95 18.88 21.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.516 -0.311 . . . . 74.13 111.174 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 21.4 t80 -56.84 -54.67 43.8 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.98 -0.378 . . . . 72.42 109.98 177.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -72.89 1.87 7.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.372 -0.376 . . . . 74.3 111.399 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -90.09 -52.59 4.87 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.833 -0.803 . . . . 72.34 108.833 173.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -70.73 -28.23 64.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.411 0.624 . . . . 74.43 110.391 176.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.537 ' HA ' ' HG2' ' A' ' 95' ' ' GLN . 1.2 tmm_? -77.75 -13.8 59.79 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.776 -0.647 . . . . 73.23 109.676 178.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -89.44 -25.54 21.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.688 -0.687 . . . . 75.42 110.569 177.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 19.9 p -87.85 -4.37 58.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.193 0.521 . . . . 71.23 110.818 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.537 ' HG2' ' HA ' ' A' ' 92' ' ' ARG . 11.5 pt20 -109.45 176.37 5.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 73.15 110.498 177.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm . . . . . 0 C--N 1.322 -0.605 0 CA-C-N 115.745 -0.661 . . . . 74.15 110.384 -178.111 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--O 1.235 0.299 0 CA-C-O 121.233 0.54 . . . . 71.53 110.247 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -100.0 4.97 45.13 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.58 -0.736 . . . . 63.42 109.795 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -150.15 134.17 16.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.347 -0.842 . . . . 63.01 109.997 -176.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 36.2 tt0 -78.93 81.55 5.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.129 -0.487 . . . . 71.41 110.854 -178.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 2.6 t30 72.64 -60.94 0.52 Allowed 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 124.107 0.963 . . . . 72.52 110.658 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -73.12 160.54 31.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.809 -0.632 . . . . 73.33 111.648 -176.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.487 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -82.25 49.47 1.42 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.338 -0.846 . . . . 73.14 111.805 -177.362 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.419 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 67.0 m-85 -53.21 -45.63 68.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.094 0.473 . . . . 54.41 110.735 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.97 -18.17 64.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.463 -0.79 . . . . 73.01 112.212 -176.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.625 HH22 HG22 ' A' ' 32' ' ' VAL . 25.4 mtp180 -90.41 -62.27 1.5 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 110.156 -0.313 . . . . 63.15 110.156 178.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.823 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -54.16 -26.75 29.57 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.091 0.775 . . . . 63.41 113.091 -177.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 13.5 t -65.58 -18.32 65.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.509 0.195 . . . . 75.31 111.188 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 21.2 mt-10 -96.49 -16.73 20.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.062 0.458 . . . . 73.15 110.391 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.823 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.9 mm? -69.11 -45.01 71.26 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.888 -0.782 . . . . 72.3 108.888 173.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.444 HG13 ' HB1' ' A' ' 39' ' ' ALA . 66.7 mt -69.2 -24.85 28.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.394 -0.821 . . . . 74.11 110.339 175.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.528 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.7 tmtp? -59.69 -35.71 75.03 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 115.678 -0.692 . . . . 72.33 110.709 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.75 HD12 HD13 ' A' ' 14' ' ' LEU . 3.0 tm? -71.41 -42.35 68.43 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.185 -0.672 . . . . 74.53 109.185 176.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -60.59 -39.07 86.74 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.094 -0.503 . . . . 75.23 111.04 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -61.22 -33.77 74.03 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.849 0.357 . . . . 74.31 111.074 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -34.78 74.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.265 -0.425 . . . . 74.21 110.459 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . 0.46 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 56.3 mt-30 -82.77 -17.34 44.53 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.364 0.602 . . . . 73.33 110.255 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . 0.722 HD21 HG23 ' B' ' 229' ' ' THR . 25.5 t-20 -76.25 -5.47 47.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.154 -0.93 . . . . 75.33 109.779 177.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -77.41 2.37 16.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 73.21 111.356 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.43 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -58.7 131.99 52.54 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.099 0.476 . . . . 71.3 110.262 175.721 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.8 t -94.69 -22.96 17.79 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.834 -0.621 . . . . 73.42 110.063 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . 0.468 ' HG2' HG13 ' B' ' 227' ' ' ILE . 1.5 pm0 -88.73 -21.82 23.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.65 -0.704 . . . . 71.53 111.455 178.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.468 HG13 ' HG2' ' B' ' 226' ' ' GLU . 6.3 mt -110.01 150.95 12.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.873 0.368 . . . . 75.42 110.619 -177.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -93.44 175.56 6.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.836 -0.62 . . . . 54.51 110.193 178.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . 0.722 HG23 HD21 ' B' ' 222' ' ' ASN . 3.4 m -64.29 -31.56 72.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.156 -0.474 . . . . 71.53 111.588 -175.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.553 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -61.5 -25.62 65.41 Favored Glycine 0 CA--C 1.523 0.546 0 N-CA-C 114.865 0.706 . . . . 71.5 114.865 -173.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -88.06 -15.99 34.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.697 0.748 . . . . 63.42 111.635 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . 0.518 HG21 ' HA ' ' B' ' 222' ' ' ASN . 35.9 t -81.11 -37.4 15.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.963 -0.295 . . . . 64.1 110.896 -176.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 8.7 p -60.25 -34.64 73.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.286 0.565 . . . . 53.11 110.567 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.11 -32.02 72.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.548 -0.751 . . . . 60.32 111.635 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 18.3 m -67.64 -32.81 73.76 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 121.137 0.494 . . . . 71.41 109.738 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.655 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 4.7 t80 -71.91 -34.81 69.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 74.33 109.239 177.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.774 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.9 tpt -60.41 -55.81 29.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.041 -0.981 . . . . 74.01 110.916 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.513 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 28.3 t-105 -63.87 -33.8 76.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.73 -0.668 . . . . 75.55 111.739 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.459 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.99 -39.61 93.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.597 -0.274 . . . . 63.3 111.16 -179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.462 HD21 ' HG3' ' A' ' 37' ' ' MET . 61.6 tp -68.19 -29.94 68.91 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.931 0.396 . . . . 74.34 110.416 179.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.09 -47.47 82.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.933 -0.576 . . . . 64.14 111.303 -178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -84.01 -5.97 59.33 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.846 -0.342 . . . . 65.15 110.902 -176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -89.37 -41.03 12.36 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.231 -0.655 . . . . 74.11 109.231 175.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -75.18 -36.73 61.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.791 -0.64 . . . . 72.24 111.761 179.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.409 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -68.01 -17.14 64.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.061 0.457 . . . . 71.34 111.021 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -68.05 -17.82 64.51 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.84 -0.618 . . . . 72.35 110.009 176.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -96.71 -0.06 48.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.124 -0.489 . . . . 75.04 111.206 177.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . 0.402 ' HA3' ' SD ' ' A' ' 81' ' ' MET . . . -75.8 -29.77 58.78 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.6 -0.81 . . . . 34.45 111.671 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 18.6 p -72.11 -18.12 61.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.865 0.365 . . . . 61.24 111.235 -177.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 15.3 t -103.95 16.79 25.51 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.538 0.685 . . . . 64.24 110.117 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 10.6 t -82.06 -44.21 16.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.585 -0.734 . . . . 72.2 110.329 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.724 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 0.4 OUTLIER -138.94 -172.37 3.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.471 -0.331 . . . . 61.54 111.159 -179.602 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -102.96 -44.57 5.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.12 -0.491 . . . . 74.11 111.592 -173.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 56.4 p -107.33 151.63 25.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.72 -0.218 . . . . 64.02 110.551 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.471 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 22.5 ptmt -63.27 -32.51 73.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.321 -0.4 . . . . 65.53 110.636 -178.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -60.14 -54.17 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.859 -0.609 . . . . 62.52 110.299 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.665 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 22.3 mt-30 -71.4 -42.88 67.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.838 -0.619 . . . . 72.02 110.363 -178.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 14.5 ttt -57.27 -42.06 80.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.083 -0.508 . . . . 50.21 111.233 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -63.23 -33.02 74.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.061 -0.518 . . . . 72.52 111.245 -178.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -78.3 -4.51 48.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.992 0.425 . . . . 44.43 111.061 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.724 ' HE2' ' HE2' ' B' ' 252' ' ' PHE . 27.1 mmmt -112.91 3.83 16.51 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.156 -176.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.651 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 17.3 ptpt -55.86 -52.97 62.17 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.073 -0.512 . . . . 54.13 110.647 -177.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.651 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.0 tp60 -66.57 -30.55 70.88 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.529 -0.305 . . . . 70.4 110.789 -176.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 65.4 mt-10 -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.437 -0.347 . . . . 75.12 111.53 -179.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.533 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 4.8 ptt? -79.47 -28.13 41.55 Favored 'General case' 0 CA--C 1.517 -0.291 0 C-N-CA 120.274 -0.57 . . . . 54.24 110.191 -176.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.619 ' HE1' ' HB2' ' A' ' 78' ' ' ASP . 72.8 mtp -77.32 -24.24 50.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.718 -0.674 . . . . 44.14 111.613 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -66.19 -25.95 67.17 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-O 121.53 0.681 . . . . 50.13 109.214 -174.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.423 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 28.1 m-85 -94.29 -17.24 22.83 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.893 -1.048 . . . . 55.15 111.35 179.083 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.485 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 22.5 m-30 -72.55 -40.45 66.7 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.247 -1.02 . . . . 63.54 108.247 171.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.564 ' SD ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -71.75 -63.61 1.09 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.033 -0.531 . . . . 74.21 110.386 169.701 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -98.84 76.87 2.19 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.742 0.645 . . . . 74.11 112.742 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 4.5 mmm180 -152.87 -34.49 0.12 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.955 -0.566 . . . . 71.31 111.081 166.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.597 ' HB3' ' HG2' ' A' ' 37' ' ' MET . 0.1 OUTLIER -83.84 0.66 46.62 Favored 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 108.988 -0.745 . . . . 74.15 108.988 179.416 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -61.29 -52.58 64.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.806 -1.088 . . . . 74.51 110.827 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -58.91 -38.74 79.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.192 0.52 . . . . 65.21 111.129 -178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . 0.62 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 55.2 mtm -80.34 -24.69 39.68 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.836 -0.62 . . . . 63.31 110.427 -177.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.475 HD22 ' HG2' ' A' ' 66' ' ' MET . 4.9 tt -72.42 -43.45 63.84 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.814 -0.81 . . . . 73.41 108.814 174.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.93 -39.85 75.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.085 -0.962 . . . . 64.44 110.291 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -61.91 -24.03 66.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.091 -0.958 . . . . 71.34 112.008 -177.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.8 m-80 -98.4 -13.98 20.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.913 0.387 . . . . 64.03 110.516 -178.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.608 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 16.1 mmt -69.66 -55.21 10.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.934 -0.575 . . . . 74.41 110.786 178.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.573 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 7.3 pt-20 -78.61 0.76 25.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.942 -0.572 . . . . 64.55 112.495 -174.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -60.73 -45.92 92.42 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.278 0.561 . . . . 71.21 109.601 173.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -82.37 -19.72 38.62 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.543 -0.753 . . . . 72.42 110.471 177.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.545 ' CG1' ' HA ' ' B' ' 282' ' ' GLU . 68.6 mt -71.87 -55.29 13.99 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-O 120.905 0.384 . . . . 74.11 110.572 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -65.78 -18.53 65.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 64.45 110.937 -178.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . 0.42 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 57.8 m-80 -112.32 18.9 18.16 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.446 -0.343 . . . . 70.52 111.462 179.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.61 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 26.4 t80 -53.59 -54.6 35.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.699 0.285 . . . . 73.23 110.833 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -77.36 2.93 14.39 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.329 -0.396 . . . . 71.24 111.246 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -88.19 -50.38 6.4 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.647 -0.871 . . . . 75.53 108.647 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -71.71 -41.86 68.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.643 -0.708 . . . . 73.13 110.285 177.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.501 ' O ' ' HD2' ' B' ' 292' ' ' ARG . 3.6 tmm_? -70.01 -13.33 62.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.799 -0.637 . . . . 72.4 110.492 -177.519 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -93.75 -30.12 15.03 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.131 -0.486 . . . . 53.05 111.01 177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 7.3 p -79.86 -21.42 44.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.581 -0.281 . . . . 65.35 111.187 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.422 ' HG2' ' HA ' ' B' ' 292' ' ' ARG . 6.8 pt20 -80.8 161.61 24.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.374 -0.375 . . . . 74.41 110.126 173.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.247 -0.882 . . . . 64.22 109.899 -174.785 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 110.185 -0.302 . . . . 73.25 110.185 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -76.31 -13.44 60.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.08 0.467 . . . . 44.32 111.002 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -80.27 116.16 20.2 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.133 -0.485 . . . . 63.04 110.083 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.561 ' HB3' ' CE2' ' A' ' 8' ' ' TYR . 3.3 tm-20 -65.28 -43.96 89.54 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.314 -0.995 . . . . 72.43 108.314 169.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.635 ' H ' ' HE2' ' A' ' 8' ' ' TYR . 9.1 t30 -148.04 -30.33 0.3 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.906 -1.043 . . . . 64.33 109.767 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.46 -162.75 1.62 Allowed 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 112.511 0.56 . . . . 71.43 112.511 -173.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.459 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.6 OUTLIER -71.58 42.33 0.08 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.097 1.359 . . . . 51.22 114.312 -172.396 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.635 ' HE2' ' H ' ' A' ' 5' ' ' ASN . 75.2 m-85 -57.9 -41.5 82.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 118.009 0.368 . . . . 73.34 111.469 -176.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.46 -18.96 65.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 64.4 111.913 -178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -92.93 -52.8 4.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.525 0.194 . . . . 74.13 111.525 177.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.812 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -54.6 -25.02 23.85 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.552 0.575 . . . . 73.41 112.552 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.9 t -68.13 -23.0 64.84 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.674 0.273 . . . . 65.32 111.028 179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.6 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.3 mt-10 -79.19 -27.22 42.59 Favored 'General case' 0 CA--C 1.522 -0.11 0 CA-C-O 121.361 0.6 . . . . 73.11 109.392 -178.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.812 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -65.75 -48.98 70.04 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.033 -0.985 . . . . 75.11 109.597 178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.502 HG23 ' HD2' ' B' ' 243' ' ' TYR . 81.4 mt -67.82 -29.44 45.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.587 -0.733 . . . . 63.52 110.198 176.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.429 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.3 tmmt? -60.18 -30.5 69.39 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.732 -0.667 . . . . 63.44 111.023 -178.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.423 HD12 HD13 ' B' ' 214' ' ' LEU . 3.0 tm? -69.32 -45.23 70.01 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.29 -0.633 . . . . 74.43 109.29 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.88 -32.27 72.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.636 -0.711 . . . . 64.01 110.921 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.604 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.6 m-20 -56.01 -35.72 67.14 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.071 -0.513 . . . . 74.43 110.624 177.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.54 -37.95 65.41 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.823 -0.626 . . . . 72.43 111.122 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 91.9 mt-30 -74.13 -22.36 59.48 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.918 0.389 . . . . 73.44 110.849 -178.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -79.71 -12.71 59.79 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.185 0.517 . . . . 71.32 109.872 177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.604 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 78.1 mm-40 -81.9 -4.85 57.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.97 -0.559 . . . . 54.41 110.328 175.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.573 ' HB3' HG13 ' A' ' 27' ' ' ILE . 1.6 t30 -80.03 135.01 36.26 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.256 0.55 . . . . 70.13 110.61 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.402 ' H ' HG22 ' A' ' 25' ' ' THR . 3.4 t -74.98 -36.39 62.03 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.228 -0.896 . . . . 70.13 111.84 -179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.58 -23.56 56.51 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.89 0.376 . . . . 74.35 111.602 -174.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.573 HG13 ' HB3' ' A' ' 24' ' ' ASN . 2.5 mt -97.12 163.43 2.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.867 0.365 . . . . 70.11 110.262 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -119.8 163.52 17.37 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.845 -0.616 . . . . 72.1 109.392 177.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.6 m -54.65 -32.21 58.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.933 0.397 . . . . 73.03 111.509 -176.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.54 -42.21 99.72 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.232 -0.508 . . . . 65.54 113.473 -178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' HB2' HG22 ' A' ' 27' ' ' ILE . 21.0 mm-40 -73.04 -37.82 66.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.127 0.463 . . . . 72.11 111.221 -173.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.9 t -69.12 -36.99 75.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.193 0.52 . . . . 73.35 110.657 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.6 m -74.94 -40.01 61.05 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.091 0.472 . . . . 43.31 110.705 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.95 -30.33 63.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.146 -0.479 . . . . 73.22 111.867 -176.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.494 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 11.0 p -66.98 -30.75 70.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.6 0.238 . . . . 74.0 110.727 -178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.548 ' CD1' HD12 ' B' ' 214' ' ' LEU . 4.9 t80 -66.16 -33.58 76.1 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.16 0.505 . . . . 63.31 109.772 177.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.544 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 5.8 ttm -70.54 -47.49 60.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.861 -0.609 . . . . 74.13 111.104 178.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -63.3 -37.89 89.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.931 0.396 . . . . 72.34 110.616 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.95 -36.8 84.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.197 -0.456 . . . . 72.12 111.196 179.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.605 HD21 ' SD ' ' B' ' 237' ' ' MET . 52.3 tp -66.62 -32.4 73.7 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.001 0.429 . . . . 63.31 110.022 178.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.464 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -66.91 -46.25 75.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.795 -0.639 . . . . 54.33 110.704 177.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.3 mtp180 -69.05 -25.11 64.3 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.896 0.379 . . . . 64.01 110.949 -178.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.411 ' O ' ' HB3' ' A' ' 46' ' ' TRP . 10.5 t80 -84.29 -45.03 13.25 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.196 -0.456 . . . . 72.35 111.057 -177.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -68.51 -28.39 66.96 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.081 0.4 . . . . 54.4 112.081 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.27 -17.14 60.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.998 0.428 . . . . 72.42 111.054 -179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.411 ' HB3' ' O ' ' A' ' 43' ' ' TYR . 22.3 t90 -66.94 -17.67 65.02 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 121.639 0.733 . . . . 72.3 110.047 176.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.433 ' CZ ' HG22 ' B' ' 229' ' ' THR . 83.0 m-85 -93.3 0.32 56.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.761 -0.654 . . . . 64.45 111.156 177.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -73.46 -37.05 53.92 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.454 -0.879 . . . . 25.24 111.323 176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.3 p -73.03 -0.21 13.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.954 0.407 . . . . 61.41 111.574 -177.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.7 t -123.53 17.55 9.66 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.338 0.59 . . . . 73.23 109.486 174.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 13.9 t -93.93 -31.43 14.29 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 115.813 -0.63 . . . . 63.51 110.867 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.712 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.2 OUTLIER -143.29 -174.29 4.17 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 120.947 0.403 . . . . 70.33 111.368 -179.838 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.678 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 7.7 pt-20 -98.54 -41.4 7.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.573 -0.74 . . . . 54.32 111.383 -173.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 82.7 p -120.93 161.84 20.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 110.094 -0.336 . . . . 70.42 110.094 -178.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 22.2 ptmt -72.88 -34.57 66.78 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.918 -0.313 . . . . 74.23 110.538 -178.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.14 -31.99 73.46 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.168 -0.469 . . . . 71.43 110.386 -178.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.666 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 20.2 mt-30 -90.48 -37.72 13.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 116.007 -0.542 . . . . 73.15 110.464 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.462 ' HE2' ' CG1' ' B' ' 285' ' ' ILE . 10.5 ttt -61.81 -42.41 98.97 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.288 -0.414 . . . . 71.34 110.988 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -62.85 -31.82 72.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.001 -0.545 . . . . 64.43 110.991 -178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.07 -6.73 58.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.23 -0.441 . . . . 51.4 111.27 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.712 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 30.2 mmmt -108.56 4.37 23.99 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 116.486 -0.325 . . . . 73.41 110.79 -178.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.455 ' O ' ' HG2' ' A' ' 65' ' ' MET . 18.3 ptpt -53.72 -45.05 70.35 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 123.338 0.399 . . . . 75.42 111.017 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.444 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 8.5 tp60 -79.9 -14.18 58.82 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.882 -0.327 . . . . 64.21 110.654 -176.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -93.37 -6.67 46.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.393 -0.367 . . . . 72.23 110.929 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 20.5 ptp -106.39 -25.05 12.07 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.323 -0.621 . . . . 74.32 109.323 169.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.516 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 82.2 mtp -94.02 -0.47 55.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.449 -0.796 . . . . 65.35 112.498 -175.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.26 -33.08 59.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.7 0.762 . . . . 72.23 109.34 -175.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.648 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 10.8 m-85 -84.27 -16.14 44.21 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.754 -1.112 . . . . 71.31 110.913 175.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.63 ' CD2' HD21 ' B' ' 277' ' ' LEU . 13.8 m-30 -73.66 -42.21 61.67 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.263 -0.426 . . . . 61.3 109.981 178.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.581 ' HE2' ' HA ' ' B' ' 274' ' ' LYS . 0.0 OUTLIER -74.72 -56.71 4.5 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.279 -0.569 . . . . 61.14 109.804 170.485 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -102.67 83.73 2.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.09 -0.504 . . . . 64.31 112.354 -171.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.648 ' HB2' ' O ' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -164.16 -36.93 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 116.092 -0.504 . . . . 74.3 111.059 169.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.436 ' HE2' ' HG ' ' B' ' 240' ' ' LEU . 0.1 OUTLIER -86.87 7.84 25.5 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 121.834 0.826 . . . . 74.23 108.838 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.429 ' HE2' HE22 ' B' ' 263' ' ' GLN . 47.6 tttm -62.64 -54.52 38.33 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 114.318 -1.31 . . . . 75.11 110.172 175.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -58.92 -35.57 73.3 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.147 -0.479 . . . . 72.02 110.625 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.408 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 50.6 mtt -67.28 -36.75 82.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.617 -0.719 . . . . 74.01 109.974 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 0.9 OUTLIER -75.47 -40.9 56.8 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.264 -0.88 . . . . 64.0 110.224 -178.442 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.414 ' N ' ' HE1' ' B' ' 266' ' ' MET . 3.8 m-20 -53.71 -38.94 64.78 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.315 0.579 . . . . 72.21 110.175 174.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -31.57 71.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.038 -0.983 . . . . 61.51 111.523 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.519 HD21 ' HG2' ' B' ' 242' ' ' ARG . 42.8 m-80 -85.09 -32.5 22.79 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.741 -0.466 . . . . 75.53 109.741 -179.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.502 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.6 mmt -62.39 -62.17 1.94 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.866 -0.606 . . . . 61.4 110.475 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 24.6 mm-40 -54.1 -31.7 52.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.853 -0.612 . . . . 64.42 111.334 -178.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.45 -46.44 80.34 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.346 0.404 . . . . 60.01 111.328 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -82.53 -28.98 30.69 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.326 -0.397 . . . . 60.35 110.695 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.518 HG21 ' HB2' ' B' ' 259' ' ' GLN . 87.3 mt -67.91 -53.48 30.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.083 -0.508 . . . . 71.44 111.549 -178.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 9.4 pt-20 -65.32 -25.69 67.72 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.788 0.328 . . . . 73.32 111.093 -178.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 63.8 m-80 -102.83 14.94 30.72 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.553 -0.294 . . . . 72.35 111.212 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.545 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 62.1 t80 -53.24 -53.83 45.08 Favored 'General case' 0 CA--C 1.519 -0.24 0 O-C-N 123.025 0.203 . . . . 75.35 111.328 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -66.53 -30.55 70.89 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.834 0.349 . . . . 73.04 110.329 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -58.51 -52.18 66.73 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.032 -0.531 . . . . 65.44 110.232 175.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -70.05 -36.83 75.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.436 0.636 . . . . 74.13 110.172 177.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.474 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 4.2 tmm_? -63.87 -20.69 66.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.316 -0.856 . . . . 75.42 109.988 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -86.55 -26.73 24.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.107 -0.497 . . . . 63.33 110.954 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 20.4 p -81.35 -20.76 39.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.411 -0.359 . . . . 70.31 111.303 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -85.56 159.02 19.98 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.671 -0.492 . . . . 75.11 109.671 175.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.8 mttm . . . . . 0 C--N 1.319 -0.746 0 CA-C-N 116.222 -0.445 . . . . 74.03 110.574 -175.371 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.233 0.234 0 CA-C-O 120.844 0.354 . . . . 63.04 111.069 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . 0.661 ' HB2' ' HB2' ' B' ' 209' ' ' ALA . 33.0 m-80 -110.91 10.66 22.32 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.283 0.563 . . . . 75.2 109.542 175.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -138.2 108.04 6.3 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.718 -0.674 . . . . 75.14 110.661 -174.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.02 -70.09 0.21 Allowed 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.484 -0.562 . . . . 65.34 109.484 170.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -142.56 9.6 1.81 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.903 0.859 . . . . 62.03 109.124 174.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.586 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -124.58 170.37 10.99 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.708 -0.678 . . . . 74.53 111.875 -171.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.494 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.3 OUTLIER -86.59 38.04 0.77 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.423 -0.808 . . . . 75.13 112.061 -175.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.586 ' CE2' ' HB3' ' B' ' 206' ' ' ALA . 65.0 m-85 -52.63 -55.71 20.54 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 111.687 0.254 . . . . 71.4 111.687 -177.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . 0.661 ' HB2' ' HB2' ' B' ' 202' ' ' ASN . . . -61.69 -18.46 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.066 -0.515 . . . . 70.21 112.338 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -86.79 -54.49 4.33 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 121.146 -0.222 . . . . 72.31 110.662 178.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.651 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.1 -28.32 51.68 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 112.432 0.53 . . . . 70.13 112.432 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 12.5 t -70.34 -16.4 62.98 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 120.759 -0.376 . . . . 64.13 111.264 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' B' ' 216' ' ' LYS . 36.8 mt-10 -82.96 -29.23 29.22 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 108.837 -0.801 . . . . 74.21 108.837 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.651 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.4 mm? -67.0 -44.8 79.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.903 -1.044 . . . . 74.22 108.95 176.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 73.0 mt -69.62 -27.39 33.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.39 -0.823 . . . . 61.32 110.512 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 1.0 OUTLIER -57.52 -38.63 74.99 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 116.259 -0.428 . . . . 40.45 110.982 -179.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.6 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -70.16 -42.59 72.31 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 109.224 -0.658 . . . . 71.42 109.224 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . 0.474 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -60.03 -42.43 94.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.058 -0.519 . . . . 63.42 110.731 178.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.568 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.4 m-20 -56.24 -34.22 66.15 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.235 -0.439 . . . . 62.4 110.587 177.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.33 -34.08 63.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.007 -0.542 . . . . 73.35 111.297 -178.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -75.39 -25.91 58.01 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.213 0.53 . . . . 72.22 110.495 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . 0.427 ' HA ' HG21 ' B' ' 232' ' ' VAL . 2.9 t-20 -68.27 -21.4 64.8 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.51 -0.768 . . . . 72.13 109.125 177.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 60.1 mm-40 -85.32 0.68 51.27 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.383 -0.826 . . . . 62.34 111.077 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.718 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 33.5 t30 -78.01 123.15 26.48 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 109.691 -0.485 . . . . 71.13 109.691 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.3 t -54.98 -26.01 33.77 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.91 -1.041 . . . . 73.54 113.434 -173.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -105.08 9.05 34.45 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.381 0.512 . . . . 73.32 112.381 -173.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.718 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 6.2 mm -108.16 152.14 10.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 121.397 0.618 . . . . 75.24 111.306 -178.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.548 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 32.8 mt-30 -92.11 152.13 20.07 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.143 -0.935 . . . . 54.03 108.596 171.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . 0.433 HG22 ' CZ ' ' A' ' 47' ' ' PHE . 16.8 m -56.46 -38.22 71.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.922 0.392 . . . . 72.21 110.755 -179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.28 -0.18 76.78 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 121.216 -0.516 . . . . 65.34 113.964 -176.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.548 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 42.1 mt-10 -90.02 -27.42 19.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.862 0.831 . . . . 71.51 110.406 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . 0.474 HG11 ' O ' ' B' ' 218' ' ' ALA . 12.1 t -76.94 -23.94 15.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.741 -0.663 . . . . 75.2 110.682 -176.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.5 p -77.46 -32.61 54.56 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.368 0.604 . . . . 52.04 109.806 174.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -73.41 -33.71 65.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.529 -0.759 . . . . 50.2 111.044 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.459 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 16.8 p -66.86 -37.11 83.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.706 0.288 . . . . 53.3 110.334 177.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.563 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.13 -37.71 84.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.424 0.631 . . . . 55.14 109.323 175.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.605 ' SD ' HD21 ' A' ' 40' ' ' LEU . 10.7 tpt -58.07 -59.77 4.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 114.924 -1.034 . . . . 54.15 111.006 177.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.408 ' HE3' ' SD ' ' A' ' 76' ' ' MET . 13.6 t-105 -59.43 -37.14 77.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.364 -0.834 . . . . 74.21 111.593 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -64.19 -39.08 93.25 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.374 -0.375 . . . . 71.13 111.34 -178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.501 HD13 ' HB3' ' A' ' 36' ' ' PHE . 53.7 tp -68.77 -33.52 74.02 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 110.29 -0.263 . . . . 75.42 110.29 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.434 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -60.51 -35.42 75.91 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.215 -0.448 . . . . 71.24 111.104 179.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . 0.519 ' HG2' HD21 ' A' ' 80' ' ' ASN . 34.5 mtp180 -80.44 -45.87 16.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.181 -0.463 . . . . 72.21 110.742 178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.502 ' HD2' HG23 ' A' ' 15' ' ' ILE . 12.2 t80 -68.52 -40.32 80.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.112 -0.495 . . . . 54.45 111.315 -174.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -64.73 -35.09 79.95 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.159 0.504 . . . . 71.25 110.931 -175.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -68.4 -2.04 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.871 -0.604 . . . . 64.43 112.242 -177.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -64.16 -26.92 68.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.218 0.532 . . . . 74.13 110.115 178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -81.76 -5.27 58.0 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 122.134 -0.354 . . . . 75.32 111.13 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -71.03 -40.55 62.1 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.643 -0.789 . . . . 53.01 111.999 178.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 4.5 p -70.04 -14.25 62.59 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.869 0.322 . . . . 54.14 111.869 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 11.0 t -111.19 19.68 18.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.364 0.602 . . . . 72.22 110.022 178.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 8.2 t -84.94 -43.79 13.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.032 -0.531 . . . . 72.44 111.29 -176.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.577 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -143.2 -177.65 5.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.362 0.601 . . . . 75.04 112.353 -176.01 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.498 ' HG2' ' HD1' ' B' ' 252' ' ' PHE . 9.6 pt-20 -92.32 -37.03 12.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.973 -1.012 . . . . 74.33 111.832 -171.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 77.7 p -126.47 161.28 28.3 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.38 -0.23 . . . . 62.51 110.38 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.545 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 17.0 ptmt -64.14 -39.02 93.12 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.102 0.251 . . . . 70.2 111.067 -177.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' B' ' 255' ' ' LYS . 37.1 mt-10 -59.89 -47.4 85.93 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.088 0.471 . . . . 75.24 111.026 -177.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.677 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.8 mt-30 -80.48 -30.04 37.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.967 -0.56 . . . . 55.43 110.421 -176.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 14.0 ttt -67.03 -45.04 78.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.051 0.453 . . . . 73.43 110.398 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.518 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.2 tt0 -63.03 -32.55 73.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.701 -0.681 . . . . 74.34 111.064 -179.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -72.9 -11.33 60.55 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.178 -0.464 . . . . 74.24 111.055 178.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.677 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -107.1 -4.13 19.22 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 110.059 -0.348 . . . . 74.12 110.059 -179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.524 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 36.4 ttpt -52.3 -56.29 15.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.761 -0.654 . . . . 65.22 110.686 -177.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.429 HE22 ' HE2' ' A' ' 74' ' ' LYS . 15.2 tp60 -64.74 -30.92 71.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 75.21 111.004 -178.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -70.12 -45.48 66.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.329 -0.396 . . . . 74.22 111.909 -176.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.524 ' CE ' ' HA ' ' B' ' 262' ' ' LYS . 3.0 ptt? -77.73 -24.43 49.12 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 119.734 -0.786 . . . . 54.42 109.542 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.474 ' HA ' ' CD2' ' B' ' 269' ' ' TYR . 84.5 mtp -79.61 -13.39 59.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.591 -0.731 . . . . 71.22 111.431 -179.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.17 -30.07 69.1 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 108.484 -0.932 . . . . 72.03 108.484 -178.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.469 ' O ' ' HB2' ' B' ' 272' ' ' ARG . 21.8 m-85 -93.7 -10.22 35.12 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.332 -1.304 . . . . 75.21 111.486 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.474 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 20.2 m-30 -79.82 -40.73 27.91 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.281 -1.007 . . . . 75.44 108.281 172.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.474 ' HE3' ' N ' ' B' ' 270' ' ' MET . 0.0 OUTLIER -69.7 -59.01 3.22 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.087 -0.506 . . . . 53.1 110.199 170.026 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.16 83.65 2.0 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 112.168 0.433 . . . . 75.4 112.168 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.469 ' HB2' ' O ' ' B' ' 268' ' ' TYR . 9.7 mmm180 -154.04 -30.02 0.12 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.972 -0.558 . . . . 72.22 110.903 166.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.544 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -90.52 6.44 43.56 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.619 -0.882 . . . . 75.1 108.619 177.039 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.581 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 85.2 tttt -61.82 -53.5 55.05 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 114.564 -1.198 . . . . 74.22 110.248 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' B' ' 275' ' ' GLU . 5.2 pt-20 -69.41 -33.61 73.26 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.055 -0.52 . . . . 53.23 110.9 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.0 mtt -61.62 -38.93 89.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.608 0.718 . . . . 73.43 109.706 173.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.63 HD21 ' CD2' ' A' ' 69' ' ' TYR . 22.6 tp -71.37 -46.07 61.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.687 -1.142 . . . . 74.14 110.786 -178.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -57.96 -40.23 80.07 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.271 0.558 . . . . 75.41 110.486 176.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -62.54 -30.72 71.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.156 -0.929 . . . . 72.51 111.196 179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 21.2 m-80 -86.31 -29.26 23.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.368 -0.378 . . . . 62.31 110.508 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.568 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -61.26 -55.42 32.11 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.879 -0.415 . . . . 73.31 109.879 174.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.611 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 71.7 mm-40 -52.98 -30.63 36.16 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 115.515 -0.766 . . . . 45.2 111.799 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -54.52 -51.36 65.39 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.396 0.435 . . . . 72.22 111.133 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -80.22 -28.65 38.54 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.356 -0.384 . . . . 75.31 111.156 179.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.568 HG13 ' O ' ' B' ' 281' ' ' MET . 76.3 mt -63.98 -53.56 42.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.823 0.344 . . . . 54.51 110.895 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.9 pt-20 -63.18 -29.01 70.44 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.42 -0.355 . . . . 51.24 111.201 -176.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . 0.463 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 61.6 m-80 -102.02 15.37 29.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.528 -0.305 . . . . 71.1 111.417 -177.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.449 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 27.0 t80 -53.22 -57.6 9.94 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.683 0.278 . . . . 73.52 111.02 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -68.07 -21.76 64.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.297 -0.41 . . . . 70.15 110.583 -175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -65.06 -58.47 5.98 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.667 -0.494 . . . . 71.43 109.667 176.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -70.19 -35.98 74.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.02 0.438 . . . . 72.44 111.342 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.562 ' O ' ' HD2' ' B' ' 292' ' ' ARG . 1.5 tmm_? -69.3 -19.85 63.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.056 -0.52 . . . . 73.13 110.53 -179.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -90.34 -34.29 15.76 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.66 0.267 . . . . 51.23 110.835 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 5.1 p -70.6 -22.45 62.54 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.323 -0.399 . . . . 54.05 111.222 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -88.73 149.29 23.53 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.16 -0.473 . . . . 53.22 110.347 175.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 67.4 mttm . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.671 -0.68 . . . . 63.45 110.175 -178.378 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 N--CA 1.475 0.821 0 CA-C-O 120.835 0.35 . . . . 34.22 110.408 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.408 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 5.8 m-20 -57.41 -44.69 84.8 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.288 -0.415 . . . . 73.31 111.023 177.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.667 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.3 p-10 -155.37 144.4 20.78 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.054 0.454 . . . . 64.12 110.767 -178.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -83.51 -80.28 0.19 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.993 -0.549 . . . . 74.02 110.169 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -105.16 -53.74 2.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.07 0.462 . . . . 74.43 109.94 177.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.667 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -82.52 161.9 22.19 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.895 -0.593 . . . . 71.2 110.808 177.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.471 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -80.41 55.14 2.19 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.895 -0.593 . . . . 73.21 112.181 -178.252 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -53.02 -42.65 65.86 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.334 -0.394 . . . . 74.33 111.844 -176.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.434 ' O ' HG22 ' A' ' 12' ' ' THR . . . -63.35 -28.39 69.97 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.136 0.421 . . . . 70.11 112.136 -176.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -80.81 -62.98 1.51 Allowed 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 121.174 -0.21 . . . . 74.51 110.608 -179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -53.91 -22.41 10.02 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.778 0.659 . . . . 54.45 112.778 -177.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 9' ' ' ALA . 1.9 t -70.02 -25.82 63.76 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.464 0.173 . . . . 64.41 110.992 -176.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.488 ' CB ' HD11 ' B' ' 217' ' ' LEU . 29.9 mt-10 -76.73 -35.5 57.74 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.373 0.606 . . . . 72.42 109.401 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.655 ' HB3' ' HZ ' ' A' ' 36' ' ' PHE . 3.0 mm? -61.11 -49.81 75.77 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 114.612 -1.176 . . . . 71.43 109.694 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.726 HG23 ' HD1' ' B' ' 243' ' ' TYR . 91.2 mt -63.36 -39.84 86.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.616 -0.72 . . . . 63.45 110.858 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 tmmt? -62.02 -31.37 71.75 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.618 -0.719 . . . . 74.0 111.516 -176.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.525 HD12 HD13 ' B' ' 214' ' ' LEU . 3.0 tm? -64.68 -42.54 95.28 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.981 -0.748 . . . . 51.43 108.981 177.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.72 -30.79 71.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.403 -0.817 . . . . 41.03 110.948 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.437 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 0.9 OUTLIER -62.57 -35.26 78.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.212 -0.449 . . . . 75.31 110.749 179.437 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -70.57 -23.25 62.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.197 -0.456 . . . . 53.23 111.23 179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -88.17 -27.29 21.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.247 0.546 . . . . 75.21 110.351 178.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -78.26 0.51 24.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 73.15 110.33 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 48.8 mt-30 -77.46 -11.81 59.89 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 74.11 111.197 178.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.436 HD22 ' HG2' ' A' ' 26' ' ' GLU . 1.8 t30 -66.04 114.14 4.98 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 109.462 -0.57 . . . . 75.11 109.462 178.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.437 ' H ' HG22 ' A' ' 25' ' ' THR . 3.8 t -77.45 58.06 1.64 Allowed 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 115.318 -0.856 . . . . 64.24 112.272 -172.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.436 ' HG2' HD22 ' A' ' 24' ' ' ASN . 11.5 pt-20 -178.0 -22.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.364 -0.38 . . . . 75.23 111.441 176.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.432 HG13 ' HB3' ' A' ' 24' ' ' ASN . 9.7 mt -84.36 148.77 4.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.881 0.372 . . . . 72.45 110.31 -177.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.709 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -72.76 145.38 47.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.825 -0.625 . . . . 61.14 109.704 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.0 m -63.39 -25.26 68.21 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.252 0.549 . . . . 75.34 109.843 178.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -73.03 -17.37 78.59 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 115.462 -0.79 . . . . 73.41 112.823 178.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.709 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 16.3 mm-40 -79.04 -22.62 45.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.417 0.627 . . . . 74.02 109.567 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.8 t -83.53 -42.44 17.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.417 -0.811 . . . . 74.01 110.088 179.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 p -62.1 -35.94 80.22 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.988 0.423 . . . . 73.14 110.177 176.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.13 -33.33 75.75 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.978 -0.555 . . . . 75.41 110.786 177.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.7 m -68.46 -36.35 78.88 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.509 -0.552 . . . . 72.52 109.509 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.655 ' HZ ' ' HB3' ' A' ' 14' ' ' LEU . 4.7 t80 -69.94 -35.05 74.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.472 -0.785 . . . . 63.22 109.49 176.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 1.013 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.8 tpt -62.35 -56.79 14.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.08 -0.964 . . . . 73.03 110.563 179.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.406 ' CB ' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -59.15 -39.09 81.32 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.637 -0.71 . . . . 72.14 111.335 177.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.05 99.09 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.404 -0.362 . . . . 60.42 111.102 -179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 52.1 tp -62.9 -38.51 91.25 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 110.021 -0.362 . . . . 74.22 110.021 176.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.429 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -61.71 -45.86 92.17 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.233 -0.439 . . . . 72.13 111.041 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.402 ' HG3' ' OD1' ' B' ' 280' ' ' ASN . 39.9 ttt180 -74.27 -18.69 60.69 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.383 -0.371 . . . . 74.32 110.923 -177.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.482 ' HD2' HG23 ' B' ' 215' ' ' ILE . 14.2 t80 -90.57 -35.35 15.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.136 0.494 . . . . 75.25 110.346 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -74.85 -39.24 61.71 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.915 -0.584 . . . . 70.15 111.185 -175.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.474 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -65.59 -18.21 65.15 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 121.035 0.445 . . . . 62.44 111.531 -178.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . 0.572 ' CH2' HG21 ' B' ' 229' ' ' THR . 16.7 t90 -63.67 -23.68 67.47 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.652 -0.703 . . . . 73.1 110.466 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.469 ' O ' HG22 ' A' ' 50' ' ' THR . 42.6 m-85 -93.61 9.71 35.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.219 -0.446 . . . . 72.5 111.075 178.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -76.74 -24.0 68.37 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.093 -1.051 . . . . 71.23 110.633 176.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.982 ' HA ' ' HE1' ' A' ' 58' ' ' MET . 14.8 m -72.38 -12.96 61.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.186 -0.507 . . . . 71.45 111.843 -177.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 47' ' ' PHE . 7.8 t -104.14 6.77 35.98 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.292 0.568 . . . . 75.1 110.612 -178.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 44.6 m -86.77 -24.78 24.96 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 112.935 0.717 . . . . 62.32 112.935 -175.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.547 ' HD1' ' H ' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -150.72 -172.31 4.16 Favored 'General case' 0 N--CA 1.463 0.224 0 O-C-N 122.095 -0.378 . . . . 63.05 111.22 179.587 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.547 ' H ' ' HD1' ' A' ' 52' ' ' PHE . 9.6 pt-20 -110.85 -35.61 5.92 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.223 -0.444 . . . . 64.11 112.197 -173.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 75.3 p -115.15 155.56 26.9 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 110.094 -0.336 . . . . 53.21 110.094 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.631 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 21.9 ptmt -66.65 -37.93 85.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.738 0.304 . . . . 62.51 110.816 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -69.69 -27.67 65.21 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.07 -0.514 . . . . 73.12 111.32 -174.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.617 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.2 mt-30 -94.05 -32.47 13.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 116.448 -0.342 . . . . 74.55 110.652 178.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.982 ' HE1' ' HA ' ' A' ' 49' ' ' SER . 16.6 ttp -72.57 -35.53 67.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.991 0.424 . . . . 74.01 110.497 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.57 ' HB2' HG21 ' B' ' 285' ' ' ILE . 35.2 tt0 -62.1 -37.55 85.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 75.14 110.654 177.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.69 -2.2 25.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.912 -0.585 . . . . 71.21 110.998 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 32.1 mmmt -110.81 0.39 17.26 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 116.32 -0.4 . . . . 74.23 110.953 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.76 ' HG3' ' H ' ' A' ' 63' ' ' GLN . 12.9 ptpt -54.97 -56.9 14.55 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.836 0.35 . . . . 62.24 110.367 -176.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.76 ' H ' ' HG3' ' A' ' 62' ' ' LYS . 14.2 tp60 -74.49 -20.13 60.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.249 -0.432 . . . . 73.03 109.843 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -79.69 -36.26 37.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.754 -0.657 . . . . 74.34 111.434 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 20.8 ptp -79.27 -27.01 42.29 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.112 -1.069 . . . . 55.05 108.112 178.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.42 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 76.7 mtp -79.36 -17.46 54.42 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.864 -1.062 . . . . 65.44 110.477 175.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -58.56 -35.01 71.68 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.318 0.58 . . . . 53.22 110.819 -172.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.745 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 14.8 p90 -108.92 -5.69 16.04 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.75 -0.659 . . . . 75.11 110.576 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.683 ' HD2' HD21 ' B' ' 277' ' ' LEU . 2.2 m-30 -60.52 -51.95 67.27 Favored 'General case' 0 N--CA 1.464 0.225 0 N-CA-C 110.469 -0.197 . . . . 75.35 110.469 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 1.038 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.25 -43.36 70.86 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.629 0.728 . . . . 75.45 109.599 172.924 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -90.0 33.98 0.86 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.798 -1.092 . . . . 71.25 112.066 -171.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.745 ' HG3' ' O ' ' A' ' 68' ' ' TYR . 35.2 mtp180 -105.85 -43.2 4.94 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.626 -0.671 . . . . 71.14 110.958 176.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.829 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -91.57 6.93 43.76 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.817 -0.353 . . . . 74.24 111.127 -175.179 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.9 tttm -60.88 -53.16 60.68 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.303 -0.408 . . . . 74.2 110.461 179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -57.52 -34.32 68.99 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.192 0.52 . . . . 60.23 110.882 178.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.8 mtt -68.28 -37.1 80.34 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 74.43 109.922 178.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.557 ' HB3' ' CE ' ' B' ' 266' ' ' MET . 0.4 OUTLIER -73.0 -43.4 62.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.194 -0.912 . . . . 75.12 110.407 -179.223 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.417 ' N ' ' HE1' ' B' ' 266' ' ' MET . 3.3 m-20 -55.31 -39.02 69.44 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.449 0.643 . . . . 74.24 110.634 178.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.69 -22.49 53.88 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.121 -0.945 . . . . 75.41 112.269 -174.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.478 ' OD1' ' HG3' ' B' ' 242' ' ' ARG . 20.2 m-80 -94.29 -8.67 38.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.446 -0.502 . . . . 63.41 111.854 -174.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.456 ' HE3' ' HA ' ' B' ' 245' ' ' ALA . 44.2 mtt -88.94 -175.24 4.78 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.216 0.532 . . . . 74.12 111.278 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.665 ' HA ' HD12 ' A' ' 85' ' ' ILE . 36.2 mt-10 69.8 -5.1 1.29 Allowed 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 114.668 -1.151 . . . . 62.02 113.207 177.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.02 -56.97 15.1 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.074 0.464 . . . . 74.33 110.703 178.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -73.78 -21.73 60.07 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.173 -0.467 . . . . 55.32 110.904 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 82' ' ' GLU . 59.7 mt -67.52 -57.79 8.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.404 -0.362 . . . . 65.12 110.407 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 23.9 pt-20 -62.8 -26.43 68.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 72.02 111.292 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 55.6 m-80 -98.49 1.45 46.67 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 111.996 0.369 . . . . 41.21 111.996 -176.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -59.23 -40.57 86.29 Favored 'General case' 0 CA--C 1.519 -0.244 0 N-CA-C 109.981 -0.377 . . . . 62.25 109.981 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -51.3 -47.42 62.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.62 -0.718 . . . . 74.34 109.962 174.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -68.69 -53.04 24.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.191 -0.913 . . . . 61.31 110.911 -175.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -57.95 -43.8 86.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.156 0.503 . . . . 63.23 111.652 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 14.2 tpp180 -74.95 -11.09 60.04 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.757 -0.656 . . . . 74.52 110.609 -177.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -96.06 -33.73 12.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.776 0.322 . . . . 43.34 111.17 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 16.4 p -73.16 -19.71 61.06 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.386 -0.37 . . . . 70.32 111.6 -178.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -90.76 169.57 10.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.152 -0.477 . . . . 65.32 110.429 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.3 mttm . . . . . 0 C--N 1.319 -0.755 0 CA-C-N 115.916 -0.583 . . . . 73.54 110.588 -174.877 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 C--O 1.233 0.221 0 CA-C-O 121.708 0.766 . . . . 63.11 109.825 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -141.95 172.44 12.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.085 -0.961 . . . . 71.51 109.213 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.562 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.0 p-10 -76.03 156.51 33.92 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 110.111 -0.329 . . . . 62.12 110.111 178.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -85.69 -113.49 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.418 -0.356 . . . . 72.44 110.512 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -91.89 -13.7 30.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.857 0.837 . . . . 50.25 109.184 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -107.55 150.44 26.85 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 115.101 -0.954 . . . . 61.14 110.471 176.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.455 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.1 OUTLIER -76.14 50.93 0.64 Allowed 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.939 -1.028 . . . . 63.24 112.486 -177.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.473 ' CZ ' ' HB3' ' B' ' 206' ' ' ALA . 63.5 m-85 -53.87 -44.28 70.26 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.725 0.298 . . . . 73.52 111.536 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -72.08 -9.04 57.86 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.147 -0.479 . . . . 74.13 111.86 -175.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 74.1 mtt180 -99.08 -59.31 1.75 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.928 -0.397 . . . . 71.45 109.928 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.736 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.12 -23.72 22.41 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.868 0.692 . . . . 71.21 112.868 179.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 9.3 t -65.05 -25.43 67.82 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.499 0.185 . . . . 74.44 111.499 -178.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.484 ' HB2' HD11 ' A' ' 17' ' ' LEU . 39.1 mt-10 -80.52 -26.39 38.13 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.359 0.6 . . . . 61.21 109.845 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.736 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.2 mm? -68.18 -47.77 67.07 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.061 -0.972 . . . . 75.23 109.341 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.482 HG23 ' HD2' ' A' ' 43' ' ' TYR . 82.1 mt -66.5 -33.01 60.68 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 CA-C-N 115.839 -0.619 . . . . 63.23 110.415 175.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.436 ' HE2' ' HB3' ' B' ' 216' ' ' LYS . 5.0 tmmm? -57.84 -36.37 72.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.529 -0.76 . . . . 73.05 110.797 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.488 HD11 ' CB ' ' A' ' 13' ' ' GLU . 2.5 tm? -66.95 -41.68 86.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.668 -0.493 . . . . 74.25 109.668 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.39 -31.74 69.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.141 -0.481 . . . . 64.55 110.94 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.79 -33.32 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.141 -0.481 . . . . 62.15 111.12 178.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -78.06 -24.75 47.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.126 -0.488 . . . . 72.21 111.764 -177.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -91.01 -17.06 26.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.395 0.617 . . . . 74.32 110.114 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -85.92 8.79 18.98 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.259 -0.882 . . . . 74.13 110.257 179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -84.18 10.05 11.25 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.947 -0.569 . . . . 71.54 111.217 177.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.465 HD22 ' CG ' ' B' ' 226' ' ' GLU . 0.8 OUTLIER -88.41 108.27 19.28 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-O 120.955 0.407 . . . . 73.21 110.763 177.83 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -74.39 -25.23 59.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.725 -0.671 . . . . 70.04 110.885 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . 0.465 ' CG ' HD22 ' B' ' 224' ' ' ASN . 11.1 pt-20 -82.2 -6.0 58.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.355 -0.384 . . . . 74.51 111.781 -176.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.743 HG22 ' H ' ' B' ' 228' ' ' GLN . 2.4 mt -124.12 179.7 2.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 109.84 -0.43 . . . . 74.13 109.84 -178.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.743 ' H ' HG22 ' B' ' 227' ' ' ILE . 2.3 mp0 -103.82 158.39 16.42 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.822 -0.436 . . . . 52.42 109.822 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . 0.572 HG21 ' CH2' ' A' ' 46' ' ' TRP . 25.4 m -67.08 -16.44 64.34 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.212 0.53 . . . . 72.42 110.656 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -62.85 -33.36 86.78 Favored Glycine 0 CA--C 1.521 0.449 0 CA-C-N 115.603 -0.726 . . . . 70.23 113.733 -178.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -72.45 -26.89 62.0 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 117.573 0.687 . . . . 71.35 110.6 -179.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.7 t -72.06 -46.76 57.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.138 -0.483 . . . . 75.2 110.129 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 3.2 p -62.49 -34.52 77.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.113 -0.494 . . . . 61.32 110.366 176.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -69.81 -35.9 75.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-N 115.912 -0.585 . . . . 72.53 111.255 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 59.8 m -67.04 -35.38 79.74 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 121.09 0.471 . . . . 44.4 109.889 -179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.576 ' CD1' HD12 ' A' ' 14' ' ' LEU . 8.5 t80 -67.47 -38.71 84.84 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.734 -0.666 . . . . 64.34 109.69 177.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.829 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.6 ttm -65.97 -48.22 71.99 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.539 -0.755 . . . . 72.14 111.42 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.471 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 17.3 t-105 -61.15 -40.53 94.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.98 0.419 . . . . 71.53 110.463 177.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.558 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.76 -42.16 99.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.882 -0.599 . . . . 55.43 110.997 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.725 HD21 ' SD ' ' A' ' 37' ' ' MET . 49.6 tp -60.75 -40.52 92.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 71.51 110.741 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -63.27 -44.4 95.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.099 -0.501 . . . . 64.01 110.671 178.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . 0.478 ' HG3' ' OD1' ' A' ' 80' ' ' ASN . 64.3 ttt180 -67.08 -32.57 73.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.572 -0.74 . . . . 74.42 110.608 -179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.726 ' HD1' HG23 ' A' ' 15' ' ' ILE . 23.0 t80 -77.52 -40.06 44.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 65.34 110.992 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -73.2 -24.49 60.53 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 111.772 0.286 . . . . 74.42 111.772 -178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.493 ' HB2' HD23 ' A' ' 77' ' ' LEU . . . -68.55 -19.77 64.51 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.247 0.546 . . . . 74.4 110.958 179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.1 t90 -59.88 -33.46 71.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.241 -0.89 . . . . 64.2 111.054 177.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -72.84 -6.52 45.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.854 -0.612 . . . . 61.3 112.502 -171.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -59.8 -30.99 70.47 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.011 -1.09 . . . . 64.14 110.916 172.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.515 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 6.6 m -66.36 -16.29 63.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.724 0.41 . . . . 74.14 111.741 -177.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.6 t -116.43 17.33 15.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.067 0.46 . . . . 35.34 110.808 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 39.8 t -81.34 -56.55 3.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.031 -0.531 . . . . 71.23 110.655 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.577 ' HE2' ' HE2' ' B' ' 261' ' ' LYS . 5.2 m-85 -137.69 178.76 6.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.083 0.468 . . . . 74.34 112.188 -177.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 8.9 pt-20 -94.76 -33.75 12.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.36 -0.836 . . . . 75.21 110.985 -173.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.425 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 75.4 p -114.21 154.34 28.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.242 -0.435 . . . . 72.35 110.211 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.505 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 21.3 ptmt -70.03 -29.8 66.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.816 0.341 . . . . 74.44 110.292 -178.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . 0.425 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.9 mp0 -55.17 -48.43 73.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.685 -0.689 . . . . 44.22 110.415 177.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.702 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 19.4 mt-30 -80.54 -41.82 23.49 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.73 -0.668 . . . . 75.42 109.986 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.515 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.1 ttt -55.18 -44.51 75.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.602 -0.726 . . . . 74.11 111.483 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.569 ' HA ' HD13 ' A' ' 85' ' ' ILE . 36.0 tt0 -64.75 -40.98 96.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.066 -0.515 . . . . 73.14 111.432 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.74 -5.96 33.85 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 53.41 111.685 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.702 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 27.6 mmmt -106.75 4.73 27.98 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.247 -0.279 . . . . 72.45 110.247 -177.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.474 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.6 ptpt -51.38 -46.0 62.66 Favored 'General case' 0 C--N 1.33 -0.282 0 O-C-N 123.431 0.457 . . . . 71.02 110.788 -177.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.474 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 11.3 tp60 -84.27 -18.03 37.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.766 0.317 . . . . 75.33 110.521 -177.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -85.24 -30.56 23.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.525 . . . . 70.54 111.26 -177.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -81.75 -29.0 33.04 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.342 -0.984 . . . . 51.33 108.342 175.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.557 ' CE ' ' HB3' ' A' ' 77' ' ' LEU . 71.9 mtp -87.87 11.23 16.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.864 -1.062 . . . . 53.32 110.462 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -75.0 -38.03 61.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.989 0.423 . . . . 74.22 111.027 -177.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.595 ' HA ' ' OD2' ' B' ' 271' ' ' ASP . 42.7 p90 -114.07 -4.21 13.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.884 -0.598 . . . . 61.42 110.818 -175.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.434 ' O ' ' HE1' ' A' ' 37' ' ' MET . 3.6 m-30 -56.68 -52.46 64.82 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 121.02 -0.272 . . . . 73.42 110.607 -178.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 1.038 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.55 -50.85 52.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.619 0.574 . . . . 71.33 110.888 177.773 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . 0.595 ' OD2' ' HA ' ' B' ' 268' ' ' TYR . 2.9 p30 -85.47 22.07 1.63 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.784 -0.643 . . . . 74.13 112.647 -171.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 33.3 mtp180 -82.03 -34.98 29.29 Favored 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 120.539 -0.464 . . . . 71.43 110.259 -179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 1.013 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.7 12.93 34.14 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 120.445 -0.502 . . . . 54.23 109.75 -179.679 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.467 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 86.5 tttt -58.49 -54.87 42.11 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.726 -0.67 . . . . 55.31 110.261 -179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -67.38 -31.76 72.22 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.573 -0.739 . . . . 74.35 111.281 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 58.2 mtt -71.49 -36.28 71.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.927 -0.579 . . . . 61.13 110.389 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.683 HD21 ' HD2' ' A' ' 69' ' ' TYR . 38.0 tp -70.35 -41.21 73.47 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.292 -0.867 . . . . 71.22 110.127 -178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -60.9 -45.26 95.32 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.782 -0.644 . . . . 75.43 110.408 178.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -66.26 -17.08 64.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.239 -0.891 . . . . 63.24 112.235 -176.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . 0.402 ' OD1' ' HG3' ' A' ' 42' ' ' ARG . 36.4 m-80 -102.13 -2.08 30.14 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.879 -0.328 . . . . 73.3 111.392 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.474 ' HG2' ' HB1' ' A' ' 45' ' ' ALA . 46.2 mtt -91.54 -177.25 4.75 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.862 -0.335 . . . . 73.32 110.428 174.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.732 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 46.1 mt-10 67.38 -3.36 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.67 -0.696 . . . . 72.24 112.598 -178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -52.29 -58.75 5.7 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.07 0.462 . . . . 74.44 110.398 176.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -84.96 -3.13 58.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.778 -0.646 . . . . 72.42 110.996 177.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.732 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 63.1 mt -85.01 -59.26 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.724 0.297 . . . . 73.12 110.437 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.615 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -67.11 -18.44 65.31 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.968 0.413 . . . . 70.11 110.561 -178.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 59.2 m-80 -107.01 6.92 29.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.133 -0.485 . . . . 75.43 111.011 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.631 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 60.7 t80 -59.19 -48.89 79.93 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.852 -0.425 . . . . 74.4 109.852 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -63.87 -31.51 72.71 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.566 -0.743 . . . . 45.31 110.443 178.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -66.78 -56.83 8.69 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.78 -0.645 . . . . 71.43 110.29 177.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . 0.476 ' O ' ' HG2' ' B' ' 295' ' ' GLN . 62.5 m-85 -64.83 -40.77 95.73 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.915 0.388 . . . . 75.21 110.979 -176.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.59 ' HB2' ' O ' ' B' ' 288' ' ' PHE . 0.2 OUTLIER -67.64 -18.32 64.91 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.862 -0.608 . . . . 74.44 110.94 -178.248 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -95.55 -29.86 14.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.226 -0.443 . . . . 71.02 111.078 -179.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 16.7 p -75.55 -10.22 59.25 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.052 0.453 . . . . 72.35 111.234 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' B' ' 291' ' ' TYR . 10.7 pt20 -117.73 171.21 8.19 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.971 -0.559 . . . . 73.14 109.981 176.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 68.4 mttm . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.416 -0.802 . . . . 74.23 109.823 -177.136 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.3 p . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 121.248 0.547 . . . . 74.44 110.861 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -124.51 -66.16 1.0 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.825 -0.625 . . . . 70.45 109.453 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.486 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 2.4 p-10 -158.21 136.56 10.94 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.422 -0.955 . . . . 51.24 108.422 177.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -84.14 -66.06 0.94 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.732 0.301 . . . . 71.21 111.416 -174.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -124.22 -41.44 2.19 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.457 -0.571 . . . . 74.24 109.457 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.486 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -76.76 157.25 31.79 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.551 -0.75 . . . . 74.54 110.635 177.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.502 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.31 43.41 0.72 Allowed 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.092 -0.958 . . . . 64.1 112.468 -175.122 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -52.48 -51.42 59.44 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.885 0.374 . . . . 73.44 111.589 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.412 ' H ' ' HB3' ' A' ' 3' ' ' ASN . . . -69.35 -5.57 24.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.955 -0.566 . . . . 53.34 111.759 -177.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.502 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 27.6 mmt180 -100.72 -58.88 1.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.313 -0.254 . . . . 75.53 110.313 178.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.739 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -52.19 -25.54 9.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.462 0.542 . . . . 62.52 112.462 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -62.89 -24.77 67.99 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.61 -0.268 . . . . 74.52 111.062 -179.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' HB2' HD11 ' B' ' 217' ' ' LEU . 34.0 mt-10 -86.24 -28.96 23.5 Favored 'General case' 0 CA--C 1.521 -0.144 0 CA-C-O 121.108 0.48 . . . . 73.51 110.024 -178.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.739 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -64.26 -47.15 80.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.587 -0.733 . . . . 70.22 109.613 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.427 HG13 ' HB1' ' B' ' 239' ' ' ALA . 62.0 mt -69.51 -28.45 37.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.931 -0.577 . . . . 64.53 110.275 176.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.555 ' HB2' ' HA ' ' A' ' 13' ' ' GLU . 2.7 mmmt -63.91 -28.69 70.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.543 . . . . 72.3 111.296 -178.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.617 HD12 HD13 ' B' ' 214' ' ' LEU . 2.7 tm? -78.27 -31.13 48.91 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.259 -0.645 . . . . 62.21 109.259 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.75 -44.06 74.54 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.719 -0.673 . . . . 71.32 109.404 -178.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.515 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 6.5 m-20 -58.21 -27.66 64.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.27 -0.877 . . . . 73.11 110.643 175.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -75.27 -32.39 61.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.095 -0.502 . . . . 75.24 110.813 -176.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 67.2 mt-30 -86.24 -20.4 28.54 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.426 0.632 . . . . 74.24 109.75 178.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -74.09 -10.05 59.23 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.142 -0.935 . . . . 73.41 109.574 176.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.515 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 80.3 mt-30 -77.48 -10.29 59.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.557 -0.747 . . . . 73.44 110.799 177.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.596 HD22 HG13 ' A' ' 27' ' ' ILE . 2.1 t30 -71.26 103.9 2.97 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.076 -0.713 . . . . 75.23 109.076 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -46.8 -44.73 19.45 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 113.528 0.936 . . . . 72.12 113.528 -173.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -81.57 -4.02 54.89 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.321 0.489 . . . . 74.54 112.321 -173.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.596 HG13 HD22 ' A' ' 24' ' ' ASN . 7.6 mt -104.0 151.4 6.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 N-CA-C 109.649 -0.5 . . . . 71.14 109.649 177.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -98.97 160.15 14.46 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.177 -0.465 . . . . 74.05 110.382 -178.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -56.08 -33.4 65.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.935 -0.575 . . . . 70.22 110.744 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.74 -33.65 83.55 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.484 -0.78 . . . . 54.1 113.828 -179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -74.63 -26.25 59.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.734 0.767 . . . . 73.44 110.365 -174.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 21.4 t -76.16 -32.84 23.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.671 -0.695 . . . . 75.04 110.305 178.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.577 ' O ' ' HG3' ' A' ' 37' ' ' MET . 92.1 p -72.4 -12.59 61.18 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.293 -0.412 . . . . 70.3 110.258 177.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -90.86 -39.72 12.16 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.121 -0.491 . . . . 73.23 110.798 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.45 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 5.6 p -67.41 -31.01 70.93 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.162 0.506 . . . . 74.34 110.276 -178.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.644 ' HB3' HD13 ' B' ' 240' ' ' LEU . 2.6 t80 -68.52 -29.38 67.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.453 -0.794 . . . . 71.35 110.378 178.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.658 ' HG2' HD21 ' B' ' 240' ' ' LEU . 51.0 mtp -77.52 -45.69 24.71 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.719 -0.219 . . . . 75.34 110.635 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 29.0 t-105 -60.67 -38.92 86.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.146 0.498 . . . . 74.44 110.138 176.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.454 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.49 -47.89 77.22 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.584 -0.735 . . . . 63.12 110.926 177.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.595 HD21 ' HG2' ' B' ' 237' ' ' MET . 51.2 tp -63.25 -40.5 97.6 Favored 'General case' 0 CA--C 1.517 -0.325 0 CA-C-O 120.714 0.292 . . . . 50.44 110.514 178.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.507 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -54.69 -46.68 74.14 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.765 -0.652 . . . . 51.12 111.496 -178.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -13.13 51.35 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.211 -0.595 . . . . 74.44 110.97 -177.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -80.94 -35.08 32.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.028 -0.73 . . . . 73.01 109.028 174.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -67.73 -35.13 78.19 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.888 -0.596 . . . . 65.1 109.535 172.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.579 ' HA ' ' HE2' ' B' ' 281' ' ' MET . . . -71.83 -17.81 62.12 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.656 -0.702 . . . . 72.11 111.529 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 22.2 t90 -63.4 -22.54 66.94 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.17 0.51 . . . . 75.11 110.224 178.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -89.32 -4.07 58.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 71.04 111.373 177.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -71.99 -37.69 60.27 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.603 -0.808 . . . . 32.23 112.124 -179.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.474 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 33.5 p -67.48 -23.18 65.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.895 0.379 . . . . 74.11 111.441 -176.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.9 t -100.19 11.28 39.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.15 0.5 . . . . 73.22 110.278 -178.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.0 t -85.88 -29.53 23.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.422 -0.354 . . . . 54.3 110.685 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.834 ' HE2' ' HE3' ' A' ' 61' ' ' LYS . 0.3 OUTLIER -145.46 -175.21 4.63 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 112.208 0.447 . . . . 72.41 112.208 -179.721 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.54 ' HG3' HG23 ' A' ' 54' ' ' THR . 10.7 pt-20 -99.1 -32.28 11.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.418 -0.81 . . . . 72.43 112.162 -172.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.54 HG23 ' HG3' ' A' ' 53' ' ' GLU . 67.6 p -128.59 156.79 42.8 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 116.241 -0.436 . . . . 65.04 109.911 -178.096 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.624 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 12.6 ptmm? -69.05 -27.52 65.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.842 0.353 . . . . 72.24 110.641 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -63.45 -49.15 74.79 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.875 -0.602 . . . . 74.31 110.294 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.639 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 22.9 mt-30 -79.71 -36.97 36.69 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.813 -0.63 . . . . 62.31 110.31 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.484 ' HE1' HG12 ' B' ' 285' ' ' ILE . 14.3 ttt -60.2 -40.42 90.03 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.04 -0.527 . . . . 62.54 111.219 178.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.666 ' HA ' HD13 ' B' ' 285' ' ' ILE . 35.3 tt0 -63.7 -30.86 71.92 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.027 -0.533 . . . . 73.14 111.231 -177.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.67 -9.23 59.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.04 0.448 . . . . 50.04 111.042 -178.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.834 ' HE3' ' HE2' ' A' ' 52' ' ' PHE . 0.2 OUTLIER -105.0 -5.46 20.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.213 -0.449 . . . . 71.51 110.338 -176.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HD2' ' N ' ' A' ' 63' ' ' GLN . 0.6 OUTLIER -51.86 -54.91 23.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 61.13 110.866 -177.603 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.506 ' N ' ' HD2' ' A' ' 62' ' ' LYS . 11.0 tp60 -75.31 -13.13 60.4 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.098 -0.501 . . . . 75.41 110.687 -175.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 62.1 mt-10 -87.55 -32.87 19.15 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.477 -0.328 . . . . 73.33 111.032 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.7 ptp -81.79 -26.73 34.17 Favored 'General case' 0 N--CA 1.453 -0.283 0 N-CA-C 108.497 -0.927 . . . . 52.13 108.497 177.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.557 ' HE3' ' HB3' ' B' ' 277' ' ' LEU . 71.6 mtp -83.3 -9.85 58.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.054 -0.975 . . . . 64.22 110.508 175.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 30.1 t70 -66.53 -18.13 65.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.996 -0.547 . . . . 73.12 111.153 -172.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.501 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 26.6 p90 -124.63 -0.69 8.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.048 -0.524 . . . . 73.41 110.637 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.586 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 1.5 m-30 -66.79 -56.85 8.61 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 121.352 -0.139 . . . . 54.23 111.045 -178.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.877 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -46.55 -54.26 9.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.122 0.487 . . . . 74.23 110.363 174.812 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -81.6 17.42 1.44 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.803 -0.635 . . . . 63.51 111.771 -174.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.586 ' HB2' ' O ' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -85.09 -50.2 7.63 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.028 0.442 . . . . 71.21 110.416 -177.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.602 ' HB3' ' HB3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -89.86 10.55 23.29 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.428 0.633 . . . . 64.14 109.646 -174.697 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 82.2 tttt -60.96 -49.73 76.24 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.069 -0.969 . . . . 65.21 110.735 -179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -58.95 -41.98 88.72 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.999 -0.546 . . . . 70.55 110.906 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 54.0 mtt -64.28 -36.45 84.13 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.653 -0.703 . . . . 73.11 110.354 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' B' ' 241' ' ' ALA . 2.3 tt -74.55 -44.88 48.94 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.326 -0.852 . . . . 73.42 110.353 -176.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -60.64 -38.74 85.8 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.327 0.584 . . . . 72.14 110.313 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.16 -24.64 66.44 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.196 -0.911 . . . . 74.24 111.668 -179.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 31.7 m-80 -99.4 -20.68 16.35 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.74 -0.384 . . . . 72.22 110.429 -178.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.746 ' HE2' ' HA ' ' B' ' 245' ' ' ALA . 16.5 mmt -61.67 -63.85 1.13 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.079 -0.51 . . . . 75.2 110.503 174.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.606 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 35.7 mt-10 -71.53 -7.34 47.01 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.074 -0.512 . . . . 75.24 111.479 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -66.89 -46.24 75.52 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.711 -0.477 . . . . 72.02 109.711 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -73.3 -35.64 66.15 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.05 -0.523 . . . . 73.12 110.268 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.606 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 86.5 mt -61.49 -54.27 37.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.853 -0.612 . . . . 54.42 111.655 -178.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.553 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 12.2 pt-20 -63.9 -19.56 65.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.822 0.344 . . . . 64.32 111.355 -177.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -104.95 6.87 33.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.466 -0.333 . . . . 74.24 111.093 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.471 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 84.3 t80 -60.97 -38.75 87.06 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 109.468 -0.567 . . . . 64.55 109.468 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.65 -45.75 81.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.325 -0.852 . . . . 52.52 109.347 175.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -62.81 -54.23 42.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.096 -0.956 . . . . 73.12 110.912 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -63.73 -35.42 80.51 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.84 0.311 . . . . 74.31 111.84 -177.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -73.45 -14.09 61.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.993 0.425 . . . . 75.23 110.628 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -93.96 -30.76 14.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.296 -0.411 . . . . 71.45 110.862 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 20.9 p -79.16 -4.88 52.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.343 0.592 . . . . 74.33 110.769 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -121.27 176.4 5.65 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.654 -0.703 . . . . 75.13 110.202 175.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 48.9 mtmt . . . . . 0 C--N 1.321 -0.669 0 CA-C-N 115.844 -0.616 . . . . 72.33 110.329 179.844 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 25.2 m . . . . . 0 C--O 1.235 0.327 0 CA-C-O 120.912 0.387 . . . . 24.24 110.526 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -123.39 154.87 38.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.133 -0.485 . . . . 74.24 110.18 179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.716 ' HB2' ' HD2' ' B' ' 208' ' ' TYR . 0.3 OUTLIER -100.35 147.77 25.43 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.624 -0.51 . . . . 74.51 109.624 176.619 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . 0.938 ' HG2' ' HE2' ' B' ' 208' ' ' TYR . 1.6 pm0 -60.52 -88.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.139 0.422 . . . . 72.43 112.139 -174.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -112.26 -40.37 4.18 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.437 -0.505 . . . . 75.32 110.957 -178.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . . . . . . . . . . . -81.69 156.66 24.95 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.176 -0.465 . . . . 70.32 111.147 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.45 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -76.92 53.4 0.93 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.228 -0.896 . . . . 74.23 112.259 -178.949 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.938 ' HE2' ' HG2' ' B' ' 204' ' ' GLU . 63.3 m-85 -55.45 -44.25 76.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.71 0.291 . . . . 73.04 111.314 -178.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.54 -20.46 64.68 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.073 -0.512 . . . . 34.13 111.925 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 24.6 mmt180 -91.44 -62.58 1.4 Allowed 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.104 -0.239 . . . . 71.24 110.686 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.746 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -53.74 -24.06 13.77 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.802 0.667 . . . . 51.33 112.802 -176.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 11.8 t -65.0 -28.09 69.27 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.672 0.272 . . . . 64.11 111.161 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.526 ' HB2' HD11 ' A' ' 17' ' ' LEU . 48.3 mt-10 -82.32 -25.23 34.1 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.331 0.586 . . . . 71.34 109.897 -176.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.746 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.3 mm? -67.04 -44.65 79.69 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.282 -0.872 . . . . 72.03 108.985 178.149 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.454 HG13 ' HB1' ' A' ' 39' ' ' ALA . 78.1 mt -73.07 -30.45 31.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.494 -0.775 . . . . 61.24 110.407 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.433 ' HB3' ' O ' ' B' ' 213' ' ' GLU . 39.4 tptt -53.58 -45.53 70.01 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.765 -0.652 . . . . 75.41 111.344 178.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.2 tm? -64.31 -40.01 95.06 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.757 -0.461 . . . . 75.34 109.757 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -62.13 -27.01 68.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.974 -0.557 . . . . 75.44 110.973 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 94.7 m-20 -66.58 -31.68 72.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 53.44 110.65 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' B' ' 217' ' ' LEU . 1.3 mp0 -74.09 -32.24 63.15 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-O 120.746 0.308 . . . . 71.44 111.338 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -82.18 -15.82 51.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.148 0.499 . . . . 72.14 110.546 -177.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -78.73 -16.08 57.66 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.839 -0.619 . . . . 65.11 109.712 176.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 59.6 mm-40 -85.5 -10.55 55.89 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.643 -0.708 . . . . 73.11 109.813 177.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.789 HD22 ' HG2' ' B' ' 226' ' ' GLU . 1.8 t30 -71.55 114.53 9.73 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.147 -0.933 . . . . 70.21 110.141 -175.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 4.4 t -58.96 -31.61 68.88 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.47 -0.786 . . . . 72.41 112.998 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . 0.789 ' HG2' HD22 ' B' ' 224' ' ' ASN . 12.0 pt-20 -82.69 -7.64 59.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.738 0.304 . . . . 70.43 111.383 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.582 ' CG2' ' HB2' ' B' ' 231' ' ' GLU . 4.5 mt -113.15 149.12 15.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 120.896 0.379 . . . . 74.01 110.419 -174.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -102.68 164.2 11.78 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.534 -0.543 . . . . 65.12 109.534 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 2.3 m -54.62 -38.51 66.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.965 0.412 . . . . 54.21 111.387 -177.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -77.63 -8.74 87.16 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.121 -0.562 . . . . 64.1 113.663 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.582 ' HB2' ' CG2' ' B' ' 227' ' ' ILE . 5.8 mm-40 -88.72 -33.32 17.56 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 117.564 0.682 . . . . 72.01 109.539 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.2 t -71.81 -38.81 66.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.4 110.272 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 21.4 p -63.5 -43.05 98.37 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.037 -0.529 . . . . 61.34 110.4 178.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -70.99 -26.6 63.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.921 -0.582 . . . . 41.53 110.866 179.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.429 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 18.5 t -66.55 -33.69 76.24 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.562 0.696 . . . . 75.14 109.158 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.609 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 5.7 t80 -73.38 -28.55 62.08 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.111 -0.949 . . . . 74.14 109.842 177.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.602 ' HB3' ' HB3' ' A' ' 73' ' ' TYR . 51.7 mtp -75.64 -46.19 32.96 Favored 'General case' 0 C--O 1.224 -0.258 0 CA-C-N 116.368 -0.378 . . . . 70.35 110.611 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.409 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 27.2 t-105 -60.85 -40.35 92.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.089 0.471 . . . . 63.24 110.166 176.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.427 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -62.54 -45.56 92.4 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.609 -0.723 . . . . 54.55 110.81 177.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.658 HD21 ' HG2' ' A' ' 37' ' ' MET . 52.1 tp -67.82 -38.41 83.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.895 0.379 . . . . 64.21 110.511 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.565 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -56.87 -49.58 75.08 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.794 -0.639 . . . . 63.31 111.472 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -86.78 6.37 31.85 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.072 -0.651 . . . . 72.32 110.887 -177.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 8.4 t80 -99.63 -36.66 9.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 108.838 -0.801 . . . . 71.13 108.838 172.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -67.35 -39.02 85.71 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.822 -0.626 . . . . 53.22 109.575 173.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.746 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -67.21 -16.55 64.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.614 -0.721 . . . . 72.41 111.732 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 78.8 t90 -58.86 -34.97 72.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.224 -0.444 . . . . 72.34 110.858 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -76.53 -2.94 34.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.524 . . . . 71.23 111.777 -178.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -67.27 -30.08 75.07 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.55 -0.833 . . . . 61.2 111.26 176.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.0 p -63.89 -22.18 66.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.954 0.407 . . . . 73.14 111.262 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.9 t -111.91 18.27 18.99 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.325 -0.398 . . . . 73.52 110.73 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 9.7 t -81.32 -39.79 24.61 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.771 -0.455 . . . . 71.5 109.771 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.863 ' HE2' ' HE3' ' B' ' 261' ' ' LYS . 0.6 OUTLIER -149.17 -174.63 4.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 74.01 111.213 179.153 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.472 ' HG3' ' N ' ' B' ' 254' ' ' THR . 12.9 pt-20 -90.34 -50.84 5.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.774 -0.648 . . . . 65.24 112.061 -175.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.472 ' N ' ' HG3' ' B' ' 253' ' ' GLU . 80.6 p -107.56 164.06 12.54 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 110.444 -0.206 . . . . 74.13 110.444 -176.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.556 ' HB2' HG23 ' A' ' 85' ' ' ILE . 22.6 ptmt -65.61 -33.48 76.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.766 0.317 . . . . 60.43 110.322 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.18 -45.8 83.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.99 -0.55 . . . . 73.23 111.072 -177.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -87.66 -7.11 57.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.134 -0.485 . . . . 64.53 111.21 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 9.9 ttt -93.29 -41.5 9.83 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.318 0.58 . . . . 75.21 109.959 175.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.536 ' HA ' HD13 ' A' ' 85' ' ' ILE . 44.4 tt0 -56.27 -42.48 77.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.199 -0.909 . . . . 74.44 111.171 -179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.29 -5.73 24.96 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.459 -0.791 . . . . 51.03 111.83 -176.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.863 ' HE3' ' HE2' ' B' ' 252' ' ' PHE . 0.1 OUTLIER -109.93 5.24 22.24 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.434 -0.348 . . . . 62.54 110.65 -175.696 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.594 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 13.5 ptpt -51.04 -47.59 61.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.119 -0.491 . . . . 64.21 111.399 -178.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.594 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 12.4 tp60 -78.89 -11.97 60.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.566 -0.288 . . . . 73.23 111.05 -173.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -83.89 -43.23 15.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.669 -0.241 . . . . 71.11 111.294 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' B' ' 265' ' ' MET . 2.7 ptt? -76.81 -30.03 56.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 119.77 -0.772 . . . . 75.21 109.382 176.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.54 ' HG2' HD22 ' A' ' 77' ' ' LEU . 62.4 mtp -88.39 16.39 6.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.805 -0.634 . . . . 72.1 110.41 177.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 20.7 t70 -90.01 -36.49 14.91 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.136 0.493 . . . . 64.33 109.696 175.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.409 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 39.8 p90 -107.72 -14.53 14.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.983 -0.553 . . . . 72.33 111.544 -174.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.1 m-30 -57.17 -60.72 3.18 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 121.018 -0.273 . . . . 73.22 110.533 178.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.877 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.07 -45.39 52.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.645 0.736 . . . . 62.02 110.181 175.935 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -84.26 9.01 14.04 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.088 -0.96 . . . . 74.04 112.052 -170.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 2.9 mtm180 -88.39 -41.4 12.84 Favored 'General case' 0 CA--C 1.513 -0.453 0 O-C-N 121.834 -0.541 . . . . 73.21 110.648 -176.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.581 ' HB3' ' HB3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -94.79 7.48 45.75 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.509 0.671 . . . . 73.31 109.268 -175.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.442 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 79.5 tttt -61.54 -57.16 13.2 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.688 -1.142 . . . . 73.33 111.14 -177.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.4 -32.6 74.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.703 0.287 . . . . 74.33 110.882 -179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 63.8 mtt -60.93 -41.12 95.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.481 0.658 . . . . 53.33 109.509 174.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.557 ' HB3' ' HE3' ' A' ' 66' ' ' MET . 0.9 OUTLIER -69.49 -41.87 75.54 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.147 -0.933 . . . . 65.02 109.73 179.08 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -58.76 -41.45 86.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.543 -0.753 . . . . 72.2 110.611 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.9 -20.87 59.53 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.255 -0.884 . . . . 75.32 112.034 -177.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 17.8 m-80 -92.25 -24.68 18.93 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.676 -0.41 . . . . 72.12 110.556 -178.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.579 ' HE2' ' HA ' ' A' ' 45' ' ' ALA . 18.3 mmt -58.98 -59.3 5.68 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.916 -0.584 . . . . 72.22 110.69 174.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.591 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 45.9 mt-10 -63.57 -20.99 66.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.595 -0.73 . . . . 72.43 112.336 -174.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -56.92 -48.72 77.6 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.176 0.512 . . . . 71.3 110.139 177.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -77.07 -25.32 52.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.005 -0.543 . . . . 74.11 110.445 178.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.666 HD13 ' HA ' ' A' ' 59' ' ' GLN . 63.4 mt -71.03 -56.31 11.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.095 -0.502 . . . . 62.01 111.279 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 10.9 pt-20 -64.4 -28.21 69.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.739 0.304 . . . . 74.53 111.64 -176.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -91.71 3.21 55.63 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.99 -0.284 . . . . 72.25 111.087 -179.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.624 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 80.4 t80 -59.14 -39.78 83.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.85 -0.159 . . . . 74.35 110.935 -179.388 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -58.91 -31.57 68.75 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.079 0.466 . . . . 71.01 110.212 178.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -74.72 -49.27 21.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.776 -0.647 . . . . 73.12 109.75 176.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -60.09 -39.38 85.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.915 -0.584 . . . . 71.22 111.455 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 16.0 tpp180 -72.29 -15.6 61.9 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.993 -0.549 . . . . 65.35 110.681 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.57 -29.35 16.98 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.951 0.405 . . . . 62.24 111.034 -178.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 10.1 p -80.21 -15.09 57.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.132 0.491 . . . . 71.53 111.415 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -111.89 170.52 8.09 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.146 -0.479 . . . . 72.41 110.906 -179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? . . . . . 0 C--O 1.251 1.152 0 CA-C-N 115.309 -0.86 . . . . 71.23 109.62 179.626 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.473 0.706 0 CA-C-O 121.067 0.461 . . . . 74.25 110.209 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.9 m120 -132.02 163.43 28.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.981 -0.554 . . . . 75.24 109.784 -177.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.5 p-10 -97.28 145.79 25.75 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.844 0.354 . . . . 74.21 110.178 -178.08 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.432 ' HB3' ' H ' ' A' ' 5' ' ' ASN . 9.4 tp10 -79.5 -86.37 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.416 -0.587 . . . . 75.35 109.416 178.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.432 ' H ' ' HB3' ' A' ' 4' ' ' GLU . 23.6 t30 -113.09 -42.71 3.49 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.765 -0.828 . . . . 71.42 108.765 170.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -71.81 154.12 41.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.271 -0.877 . . . . 71.11 111.972 -179.18 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.487 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -77.77 57.07 1.6 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.239 -1.346 . . . . 74.31 111.954 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.436 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 67.3 m-85 -54.75 -40.91 69.83 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.315 -0.402 . . . . 63.44 111.802 -178.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.74 -16.18 61.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 65.02 111.655 -174.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.5 mmt180 -87.33 -60.91 1.84 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.532 -0.304 . . . . 73.11 110.389 176.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.795 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -61.53 -16.74 50.5 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 112.887 0.699 . . . . 53.13 112.887 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.552 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 14.7 t -65.05 -30.44 71.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 121.035 -0.266 . . . . 53.32 111.016 -179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.541 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.2 mt-10 -81.6 -26.36 34.96 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.167 0.508 . . . . 74.43 110.151 -176.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.795 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.6 mm? -63.6 -41.67 98.3 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.543 -0.753 . . . . 73.43 109.804 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.497 HG23 ' HD2' ' B' ' 243' ' ' TYR . 69.1 mt -72.71 -22.74 20.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.609 -0.723 . . . . 70.02 110.688 178.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 12' ' ' THR . 30.7 mmmt -64.42 -34.57 78.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.564 -0.289 . . . . 74.11 111.024 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -63.13 -37.27 86.55 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.009 -0.737 . . . . 75.51 109.009 177.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.47 71.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.657 -0.701 . . . . 74.05 110.491 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.52 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 12.1 m-80 -59.96 -43.53 95.0 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.762 -0.654 . . . . 63.51 110.553 177.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -65.46 -35.23 80.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.769 -0.651 . . . . 73.24 111.436 -179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -79.37 -27.21 41.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.053 0.454 . . . . 72.41 110.633 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.88 -0.91 36.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.316 0.579 . . . . 73.41 110.288 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 94.4 mt-30 -75.16 -8.85 57.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.034 -0.53 . . . . 72.32 109.982 174.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.608 HD22 ' HG2' ' A' ' 26' ' ' GLU . 1.4 m120 -78.93 156.14 28.68 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.323 -0.853 . . . . 75.54 110.1 175.168 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.2 t -128.46 -14.78 4.66 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.131 0.491 . . . . 61.12 109.922 175.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.608 ' HG2' HD22 ' A' ' 24' ' ' ASN . 1.6 pm0 -83.94 -2.73 57.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.563 -0.744 . . . . 64.32 110.303 174.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.2 mt -122.86 149.28 26.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 108.829 -0.804 . . . . 55.13 108.829 173.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.722 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 0.8 OUTLIER -77.8 150.68 34.25 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.813 0.339 . . . . 64.53 110.391 -179.875 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -61.3 -31.4 71.24 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.288 0.566 . . . . 72.11 109.771 174.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.712 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -68.08 -22.14 74.07 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.495 -0.775 . . . . 65.12 113.296 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.722 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 11.3 mm-40 -74.24 -34.25 63.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.334 0.588 . . . . 73.42 109.69 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.5 t -69.43 -44.61 79.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.592 -0.731 . . . . 73.12 110.534 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.421 ' HB3' ' CE1' ' B' ' 243' ' ' TYR . 15.1 p -65.29 -39.43 92.52 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.096 -0.502 . . . . 71.34 110.709 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -64.95 -35.01 79.79 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.847 -0.615 . . . . 64.33 110.383 177.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.538 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 52.5 m -63.83 -40.26 96.18 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 120.847 0.356 . . . . 73.41 110.096 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.703 ' HD1' HD12 ' B' ' 214' ' ' LEU . 10.4 t80 -62.06 -40.53 96.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.362 0.601 . . . . 64.31 109.737 177.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.676 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 12.4 ttm -67.14 -45.44 77.08 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.582 -0.736 . . . . 72.22 111.612 179.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.604 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 18.8 t-105 -64.61 -35.79 82.16 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.986 0.422 . . . . 72.03 110.568 177.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.447 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -64.74 -39.39 93.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.134 -0.485 . . . . 61.02 110.657 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 56.4 tp -65.62 -35.6 81.3 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.466 -0.334 . . . . 71.24 110.161 177.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -60.3 -44.13 95.68 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.132 -0.485 . . . . 71.52 110.809 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 54.7 mtm180 -73.23 -35.68 66.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.175 -0.466 . . . . 62.31 110.627 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.406 ' HE1' ' OG ' ' B' ' 233' ' ' SER . 9.9 t80 -73.7 -33.51 64.44 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.917 -0.583 . . . . 63.42 110.786 -177.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 6.8 t-20 -76.09 -35.71 59.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.083 0.468 . . . . 41.3 110.767 -177.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.73 -15.1 63.3 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.913 -0.585 . . . . 74.45 111.311 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 82.5 t90 -59.29 -35.82 74.46 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.714 -0.676 . . . . 74.54 111.428 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.526 ' HZ ' ' HA2' ' B' ' 230' ' ' GLY . 61.3 m-85 -71.44 -9.08 57.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.402 -0.363 . . . . 62.2 111.888 -176.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.65 -29.56 64.31 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.349 -0.929 . . . . 62.25 111.294 175.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.526 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 50.2 p -61.44 -32.77 72.75 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.709 0.29 . . . . 53.53 111.652 -178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 14.7 t -103.1 16.86 25.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.185 0.517 . . . . 71.2 110.695 -176.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 t -76.29 -47.34 24.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.167 -0.469 . . . . 72.15 110.72 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.457 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 0.9 OUTLIER -142.68 -175.11 4.35 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.32 0.581 . . . . 71.25 112.297 -176.929 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -99.09 -28.06 13.55 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.916 -1.038 . . . . 61.12 111.679 -173.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.2 p -127.56 160.01 32.88 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.14 -0.482 . . . . 55.54 110.302 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.592 ' HB3' ' HB3' ' B' ' 288' ' ' PHE . 19.5 ptmt -68.92 -38.01 79.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.548 -0.296 . . . . 75.35 111.19 -177.132 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.98 -30.2 71.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.502 -0.317 . . . . 74.42 111.415 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -92.29 -29.12 16.55 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.031 0.443 . . . . 63.01 110.557 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.526 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 17.8 ttt -69.73 -43.8 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.724 -0.671 . . . . 73.34 110.778 178.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.625 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.1 tt0 -62.62 -33.47 75.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.699 -0.682 . . . . 71.14 111.639 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.02 -23.75 64.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.095 0.474 . . . . 74.31 111.133 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.457 ' HG3' ' CD2' ' A' ' 52' ' ' PHE . 31.3 mmmt -89.32 -0.36 57.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.917 -0.583 . . . . 63.24 110.777 -174.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.588 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 10.0 ptpp? -51.75 -47.16 64.2 Favored 'General case' 0 C--O 1.224 -0.267 0 O-C-N 123.597 0.561 . . . . 73.04 110.491 -175.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.588 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.6 tp60 -86.15 -21.92 27.3 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.085 -0.507 . . . . 65.54 110.214 -175.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.4 ' OE2' ' HD2' ' A' ' 61' ' ' LYS . 48.8 mt-10 -73.41 -40.54 64.19 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.601 -0.727 . . . . 63.15 110.837 -179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 20.4 ptp -79.26 -27.58 42.35 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 121.257 0.551 . . . . 63.33 109.584 -178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.425 ' HG3' ' O ' ' A' ' 62' ' ' LYS . 90.2 mtp -78.71 -17.33 56.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.813 -0.63 . . . . 65.4 110.915 177.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -60.63 -31.27 70.47 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.196 0.522 . . . . 35.43 111.345 -172.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 14.7 p90 -108.65 -10.43 15.2 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.598 -0.441 . . . . 72.14 111.005 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.531 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 5.4 m-30 -58.7 -53.94 52.74 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.623 0.249 . . . . 75.5 111.088 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.696 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -50.97 -53.63 31.41 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.254 0.55 . . . . 75.24 110.725 175.825 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.569 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 4.2 t70 -89.5 32.53 0.86 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.394 -0.821 . . . . 74.32 110.817 -172.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.659 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 2.1 mmm180 -94.01 -37.26 11.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.254 -0.43 . . . . 71.24 111.221 -177.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.718 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -100.19 10.77 40.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.479 -0.328 . . . . 71.31 110.464 -178.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.8 tttp -59.28 -59.72 5.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.589 . . . . 73.52 110.578 -176.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -63.35 -29.44 70.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.735 -0.666 . . . . 75.3 111.561 -177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.538 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 39.9 mtm -79.49 -27.77 41.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.226 0.536 . . . . 64.23 109.935 -179.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.772 HD21 ' HD2' ' B' ' 269' ' ' TYR . 65.1 tp -70.11 -43.77 70.34 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.48 -0.782 . . . . 71.4 109.676 176.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -59.02 -34.09 71.49 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.278 -0.874 . . . . 72.01 110.506 175.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -76.17 -12.49 60.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.41 -0.814 . . . . 54.25 112.125 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.436 ' OD1' ' HG2' ' B' ' 242' ' ' ARG . 31.4 m-80 -100.92 -20.41 15.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.988 0.423 . . . . 63.15 111.322 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.417 ' C ' ' H ' ' A' ' 83' ' ' ASP . 63.0 mtt -78.84 -168.07 1.32 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.363 -0.38 . . . . 74.54 110.019 172.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 6.4 mm-40 68.46 -32.31 0.21 Allowed 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 113.741 1.015 . . . . 74.4 113.741 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.417 ' H ' ' C ' ' A' ' 81' ' ' MET . 27.8 t70 -53.25 -58.3 7.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.88 0.326 . . . . 55.12 111.88 -177.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 51.0 p90 -88.53 -3.52 58.79 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.875 -0.73 . . . . 74.44 111.121 179.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.573 HG21 ' HB2' ' B' ' 259' ' ' GLN . 48.6 mt -74.78 -56.91 7.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.082 0.468 . . . . 72.32 109.84 173.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 10.0 pt-20 -60.86 -38.71 86.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.074 -0.512 . . . . 62.04 110.672 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -87.93 8.93 23.96 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.293 -0.412 . . . . 61.42 111.651 -177.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.5 ' O ' ' HB2' ' A' ' 92' ' ' ARG . 72.8 t80 -57.72 -42.32 83.58 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.158 -0.312 . . . . 70.23 110.158 178.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -57.96 -36.58 72.77 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.156 0.503 . . . . 72.41 110.019 177.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.544 ' O ' HG23 ' A' ' 94' ' ' THR . 6.3 t60 -69.26 -52.41 27.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.192 -0.913 . . . . 72.23 110.291 -178.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -64.59 -39.97 94.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.898 0.38 . . . . 74.03 111.071 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.1 OUTLIER -66.87 -17.69 65.02 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.221 0.534 . . . . 71.12 110.264 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -94.36 -24.21 17.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.825 -0.625 . . . . 64.14 111.141 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 90' ' ' HIS . 81.9 p -72.36 -23.7 61.16 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.003 0.43 . . . . 51.45 110.872 -179.401 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -90.46 125.3 35.53 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.407 0.622 . . . . 72.53 110.044 178.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 115.329 -0.85 . . . . 44.44 111.259 -175.56 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 120.832 0.349 . . . . 73.03 110.482 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -81.01 173.64 12.41 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.734 -0.469 . . . . 62.0 109.734 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.67 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.1 p-10 -98.54 143.45 28.93 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.653 -0.499 . . . . 75.32 109.653 178.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -76.11 -83.43 0.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.11 -0.7 . . . . 74.23 109.11 177.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -119.57 -30.81 4.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.103 -0.702 . . . . 51.44 109.103 170.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.67 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -88.47 157.18 18.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.688 -0.687 . . . . 64.45 111.811 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.538 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.2 OUTLIER -86.15 49.57 1.81 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.627 -1.17 . . . . 74.42 111.954 -175.571 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -45.13 -50.22 11.35 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 112.438 0.533 . . . . 72.34 112.438 -176.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . 0.517 ' O ' ' HB ' ' B' ' 212' ' ' THR . . . -59.88 -44.09 94.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.124 -0.489 . . . . 75.34 112.229 -174.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.44 ' HD3' ' HA ' ' B' ' 210' ' ' ARG . 32.3 mmt180 -67.28 -49.99 62.1 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.148 0.425 . . . . 64.2 112.148 -175.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.631 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -63.3 -18.71 63.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.691 0.758 . . . . 72.31 110.62 -177.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . 0.517 ' HB ' ' O ' ' B' ' 209' ' ' ALA . 49.3 m -68.64 -28.12 66.61 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.006 -0.997 . . . . 54.31 111.014 176.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.408 ' HB2' HD11 ' A' ' 17' ' ' LEU . 28.4 mt-10 -80.06 -29.32 39.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.462 0.649 . . . . 74.03 109.509 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.703 HD12 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -63.94 -45.43 89.24 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.214 -0.903 . . . . 75.43 109.922 177.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.447 HG13 ' HB1' ' A' ' 39' ' ' ALA . 77.3 mt -66.8 -24.82 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.68 -0.691 . . . . 54.41 110.302 176.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.416 ' HD2' HE22 ' B' ' 220' ' ' GLN . 0.0 OUTLIER -66.39 -30.57 70.97 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.91 -0.586 . . . . 74.35 110.661 -176.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.631 HD12 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -70.37 -40.75 73.81 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 108.783 -0.821 . . . . 70.11 108.783 175.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.58 -29.88 70.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.474 -0.784 . . . . 75.45 110.183 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.519 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 2.7 t-20 -59.9 -38.34 81.99 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.33 -0.85 . . . . 71.24 110.405 179.352 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . 0.416 HE22 ' HD2' ' B' ' 216' ' ' LYS . 2.9 mp0 -69.41 -39.71 77.76 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.763 -0.653 . . . . 63.21 111.282 -179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -74.0 -25.24 59.8 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.159 0.504 . . . . 75.54 110.163 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -84.07 -3.64 58.2 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.837 -0.62 . . . . 63.4 110.751 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 98.5 mt-30 -71.03 -10.73 60.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.436 0.636 . . . . 70.01 109.94 173.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.557 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.7 OUTLIER -83.42 128.55 34.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.05 -0.977 . . . . 72.31 109.723 177.057 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -98.46 -21.82 16.36 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.079 0.466 . . . . 61.23 110.817 -175.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . 0.557 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.6 pm0 -76.9 -17.93 58.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.084 0.469 . . . . 70.21 110.724 176.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . . . . . . . . . 7.3 mt -98.95 153.49 4.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.518 -0.919 . . . . 72.13 108.518 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.579 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 1.3 mp0 -80.57 146.38 31.28 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 109.454 -0.572 . . . . 73.03 109.454 176.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 27.6 m -58.25 -33.12 69.02 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.221 -0.659 . . . . 63.1 109.221 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.526 ' HA2' ' HZ ' ' A' ' 47' ' ' PHE . . . -61.71 -29.71 72.84 Favored Glycine 0 C--N 1.334 0.44 0 CA-C-N 115.084 -0.962 . . . . 24.42 113.149 177.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.579 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 11.4 mm-40 -66.2 -36.43 83.05 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 117.356 0.578 . . . . 63.33 109.657 179.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 16.1 t -77.78 -27.75 15.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.371 -0.831 . . . . 65.22 110.108 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . 0.462 ' HG ' ' HE2' ' A' ' 47' ' ' PHE . 1.8 m -70.83 -40.92 72.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.797 -0.638 . . . . 55.34 109.46 176.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -71.44 -34.34 70.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.264 -0.88 . . . . 71.11 111.223 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.477 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 30.1 p -67.89 -36.41 80.18 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 120.949 0.404 . . . . 63.13 110.016 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.58 ' CD1' HD12 ' A' ' 14' ' ' LEU . 6.6 t80 -62.45 -42.04 99.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.522 0.677 . . . . 73.43 109.421 174.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.718 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 8.6 ttm -66.09 -45.83 79.82 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.518 -0.764 . . . . 74.14 111.733 179.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.538 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 33.9 t-105 -63.7 -35.45 80.6 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 72.42 110.716 177.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -66.17 -35.48 80.58 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.499 -0.319 . . . . 75.34 110.789 179.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 52.4 tp -68.04 -35.87 78.97 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 109.285 -0.635 . . . . 75.24 109.285 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.441 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -66.15 -16.84 64.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.788 -0.642 . . . . 74.32 111.185 179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . 0.436 ' HG2' ' OD1' ' A' ' 80' ' ' ASN . 36.8 mtm180 -95.47 -47.77 6.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.993 0.425 . . . . 64.32 110.411 176.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.497 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.6 t80 -70.99 -34.57 71.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.827 -0.624 . . . . 70.51 111.221 -173.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -81.33 -20.28 41.03 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.056 0.455 . . . . 62.34 111.229 -175.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -78.8 -7.46 57.87 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.086 0.469 . . . . 74.13 110.746 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 75.0 t90 -65.45 -27.64 68.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.487 -0.779 . . . . 73.45 110.908 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.712 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 74.2 m-85 -75.09 -0.52 19.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.08 -0.509 . . . . 72.12 112.037 -175.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -63.2 -27.59 70.83 Favored Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.096 -1.05 . . . . 72.22 110.694 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 75.7 p -70.16 -8.63 51.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.456 -0.372 . . . . 72.34 111.672 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 10.8 t -120.87 8.29 10.5 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.967 -0.293 . . . . 53.03 110.873 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 68.6 m -78.0 -44.3 27.03 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-O 120.63 0.252 . . . . 65.32 110.641 178.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.486 ' CE2' ' HE3' ' B' ' 261' ' ' LYS . 2.4 m-85 -149.07 177.57 9.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.867 0.365 . . . . 74.22 111.231 178.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.403 ' HG3' HG23 ' B' ' 254' ' ' THR . 8.9 pt-20 -91.5 -34.83 14.63 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.588 -0.733 . . . . 70.24 111.897 -172.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.403 HG23 ' HG3' ' B' ' 253' ' ' GLU . 75.4 p -117.98 161.4 19.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.411 -0.359 . . . . 70.44 110.508 -179.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.442 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.5 ptmt -66.55 -35.05 79.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.488 -0.324 . . . . 61.11 110.954 -176.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.09 -50.03 73.55 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.061 0.458 . . . . 74.05 110.788 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.662 ' O ' ' HD3' ' B' ' 261' ' ' LYS . 22.0 mt-30 -75.51 -23.62 56.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.955 -0.566 . . . . 75.14 110.392 -177.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.3 ttt -77.32 -47.52 19.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.296 -0.411 . . . . 74.05 110.665 177.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.573 ' HB2' HG21 ' A' ' 85' ' ' ILE . 33.6 tt0 -63.65 -35.07 79.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.693 -0.685 . . . . 63.13 111.689 -176.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.46 -13.31 62.22 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.844 0.354 . . . . 70.35 110.975 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.662 ' HD3' ' O ' ' B' ' 257' ' ' GLN . 3.2 mptp? -106.51 9.95 31.42 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.956 -0.566 . . . . 72.05 111.134 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.551 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 19.0 ptpt -50.37 -46.33 55.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.086 0.47 . . . . 73.42 110.259 178.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.551 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 14.2 tp60 -80.54 -29.74 37.15 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.054 -0.521 . . . . 74.3 110.057 -177.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -67.26 -39.09 86.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.277 -0.42 . . . . 71.02 111.413 -179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 23.3 ptp -83.72 -24.29 31.27 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.563 -0.532 . . . . 70.05 109.563 -177.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . . . . . . . . . 75.4 mtp -85.03 -22.37 29.05 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.781 -0.645 . . . . 73.43 111.599 179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 17.0 t70 -62.21 -42.64 99.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.992 0.425 . . . . 72.41 111.025 -170.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.624 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 27.3 p90 -90.35 -14.42 33.12 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.907 -0.588 . . . . 72.02 110.647 -178.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.772 ' HD2' HD21 ' A' ' 77' ' ' LEU . 1.3 m-30 -57.54 -47.12 82.89 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.606 0.241 . . . . 75.21 111.052 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.569 ' HG2' ' HA ' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -56.2 -48.13 77.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.195 0.521 . . . . 75.34 110.422 174.689 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -84.4 20.8 1.58 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.491 -0.777 . . . . 65.34 111.65 -171.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 14.6 mmm180 -90.38 -51.09 5.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.03 0.443 . . . . 71.11 110.813 -174.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.696 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -92.65 8.83 37.43 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.069 -0.514 . . . . 75.02 110.538 -177.185 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.485 ' HG3' ' SD ' ' A' ' 70' ' ' MET . 87.8 tttt -59.59 -59.48 5.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.919 -0.582 . . . . 73.4 110.916 -177.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.33 -33.98 77.08 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.23 -0.441 . . . . 63.23 111.187 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . 0.604 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 41.0 mtm -72.23 -29.63 64.12 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.108 0.48 . . . . 74.4 110.441 -178.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 5.5 tt -70.96 -43.42 68.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.998 -0.742 . . . . 74.04 108.998 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -56.38 -37.13 69.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.961 -1.018 . . . . 70.34 111.12 178.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -68.47 -14.98 63.38 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.447 -0.797 . . . . 75.04 112.36 -176.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -96.6 -13.33 22.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.878 0.371 . . . . 64.32 111.487 -178.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . . . . . . . . . 62.9 mtt -85.56 179.58 7.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.777 0.323 . . . . 72.12 111.122 176.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.559 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 20.6 mt-10 69.89 -24.06 0.15 Allowed 'General case' 0 N--CA 1.462 0.151 0 C-N-CA 124.416 1.086 . . . . 64.02 113.381 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -50.25 -60.18 3.23 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.896 0.379 . . . . 73.43 111.699 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -85.13 5.66 28.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.414 -0.357 . . . . 62.23 111.221 178.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.625 HG21 ' HB2' ' A' ' 59' ' ' GLN . 50.3 mt -92.82 -54.73 6.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.876 0.37 . . . . 74.32 110.507 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 9.8 pt-20 -62.04 -30.91 71.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.053 -0.521 . . . . 54.13 110.337 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -96.38 2.28 52.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.954 -0.566 . . . . 75.01 111.359 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.592 ' HB3' ' HB3' ' A' ' 55' ' ' LYS . 71.0 t80 -55.99 -48.19 76.34 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.634 0.254 . . . . 74.23 110.915 -177.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -65.21 -31.33 72.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.182 -0.463 . . . . 74.33 110.712 -178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -65.55 -57.07 9.08 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.247 -0.649 . . . . 75.44 109.247 177.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . 0.518 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 21.3 m-85 -61.55 -46.88 88.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.653 -0.703 . . . . 70.44 111.325 -179.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 3.9 tpm_? -55.83 -32.84 63.94 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.98 0.419 . . . . 73.22 111.048 179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -76.42 -28.65 56.73 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 116.065 -0.516 . . . . 72.05 111.694 -175.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 24.3 p -97.24 -16.45 20.35 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.39 -0.368 . . . . 73.4 111.734 -177.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 25.7 mt-30 -91.04 143.71 26.42 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.32 0.581 . . . . 74.54 111.648 -177.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt . . . . . 0 C--O 1.248 0.986 0 CA-C-N 115.076 -0.965 . . . . 73.13 109.4 -179.43 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 121.173 0.511 . . . . 70.34 111.173 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -104.41 -54.64 2.49 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.083 -0.71 . . . . 65.54 109.083 173.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -162.43 135.25 5.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.168 -0.924 . . . . 63.2 108.944 175.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.98 -79.69 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.123 0.487 . . . . 64.51 110.759 -178.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -125.71 -35.85 2.48 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.947 -0.569 . . . . 62.24 110.393 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.404 ' HB3' ' CZ ' ' A' ' 8' ' ' TYR . . . -80.81 159.82 25.0 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.091 -0.504 . . . . 74.35 111.005 179.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.567 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.2 OUTLIER -82.06 49.17 1.34 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.293 -0.867 . . . . 71.4 111.995 -176.413 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.404 ' CZ ' ' HB3' ' A' ' 6' ' ' ALA . 58.1 m-85 -51.93 -42.21 62.63 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.046 0.451 . . . . 74.21 111.235 -178.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.11 -13.64 61.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.742 -0.663 . . . . 74.21 112.509 -175.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.437 ' HD3' HH11 ' A' ' 10' ' ' ARG . 20.5 mtm180 -94.71 -57.23 2.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.542 -0.463 . . . . 72.24 110.262 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.768 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -57.49 -22.47 44.07 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.54 0.571 . . . . 55.01 112.54 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -62.75 -26.92 68.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.745 0.307 . . . . 71.44 110.955 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.487 ' HB2' HD11 ' B' ' 217' ' ' LEU . 30.0 mt-10 -83.12 -29.56 28.61 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.169 0.509 . . . . 73.02 109.772 -178.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.768 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -62.82 -48.58 78.48 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.244 -0.889 . . . . 74.54 109.42 177.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.512 HG23 ' HD2' ' B' ' 243' ' ' TYR . 78.5 mt -64.07 -33.63 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.747 -0.661 . . . . 73.14 110.281 176.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.414 ' HE3' ' HB3' ' A' ' 16' ' ' LYS . 1.6 tmmt? -60.11 -35.13 74.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.608 -0.724 . . . . 75.5 111.48 -176.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.463 HD12 HD13 ' B' ' 214' ' ' LEU . 2.6 tm? -63.54 -45.97 88.1 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 109.392 -0.596 . . . . 51.41 109.392 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.53 -30.59 68.7 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.723 -0.671 . . . . 61.22 111.225 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 18.7 m-80 -64.45 -26.33 68.4 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.242 -0.435 . . . . 62.11 111.214 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.585 ' HA ' ' NE2' ' A' ' 23' ' ' GLN . 2.9 mp0 -81.07 -14.97 57.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.838 0.351 . . . . 75.35 111.057 178.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -101.44 -35.28 9.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.95 0.405 . . . . 71.23 110.764 178.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.649 ' HA ' HG21 ' A' ' 32' ' ' VAL . 0.2 OUTLIER -78.0 -8.95 58.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.208 -0.451 . . . . 73.31 110.721 -175.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.585 ' NE2' ' HA ' ' A' ' 20' ' ' GLN . 8.7 pt20 -80.87 9.0 7.0 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.839 -0.344 . . . . 74.21 111.531 178.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.598 HD22 HG13 ' A' ' 27' ' ' ILE . 1.8 t30 -82.84 103.46 12.34 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.231 -1.026 . . . . 74.51 108.231 173.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 5.7 t -60.16 -31.68 70.33 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 113.146 0.795 . . . . 74.01 113.146 -169.249 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -80.68 -13.43 59.03 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.227 0.455 . . . . 74.13 112.227 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.598 HG13 HD22 ' A' ' 24' ' ' ASN . 9.2 mt -98.66 147.8 6.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.448 -0.575 . . . . 50.01 109.448 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -89.42 159.75 17.14 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 120.824 0.345 . . . . 73.23 110.301 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.3 m -56.88 -33.33 66.77 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.529 -0.759 . . . . 75.51 111.315 -176.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -58.27 -32.4 67.75 Favored Glycine 0 C--N 1.332 0.34 0 CA-C-N 115.62 -0.718 . . . . 54.31 113.871 -176.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -69.27 -31.79 70.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.27 0.535 . . . . 74.31 110.932 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.649 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.3 t -88.63 -40.82 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.855 -0.611 . . . . 70.45 110.967 -176.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.8 p -61.59 -41.78 97.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.953 0.406 . . . . 72.33 110.635 179.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.29 -32.3 73.88 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.014 -0.539 . . . . 74.33 110.958 178.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.479 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 46.2 m -63.51 -36.21 83.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.886 0.374 . . . . 61.41 110.068 178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.556 ' CD1' HD12 ' B' ' 214' ' ' LEU . 2.5 t80 -69.5 -32.78 71.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.374 0.606 . . . . 73.44 109.66 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.786 ' SD ' HD21 ' B' ' 240' ' ' LEU . 8.2 tpt -67.36 -52.33 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.45 -0.795 . . . . 71.02 110.945 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.652 ' HB3' ' HE1' ' B' ' 207' ' ' PHE . 20.8 t-105 -63.84 -34.89 78.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.937 -0.574 . . . . 75.45 110.906 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.41 -40.64 97.74 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.122 -0.49 . . . . 75.51 111.095 179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 53.9 tp -68.37 -35.29 77.5 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.734 -0.469 . . . . 64.25 109.734 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.9 -37.88 77.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.19 -0.459 . . . . 75.4 111.0 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.448 ' HG2' ' CG ' ' B' ' 280' ' ' ASN . 10.8 mtp180 -77.48 -46.46 22.42 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.019 -0.272 . . . . 74.24 111.139 177.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.588 ' HD2' HG23 ' B' ' 215' ' ' ILE . 7.5 t80 -66.57 -31.86 72.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.21 -0.45 . . . . 62.41 110.884 -175.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -77.33 -38.3 50.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.038 0.447 . . . . 52.51 109.95 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.88 -19.61 65.04 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.792 -0.64 . . . . 63.21 111.171 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 14.5 t90 -59.39 -33.54 71.32 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.845 -0.616 . . . . 72.13 110.029 176.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -82.66 -5.47 58.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 62.14 111.131 178.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.524 ' O ' ' HE3' ' A' ' 58' ' ' MET . . . -70.62 -23.87 77.36 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 110.896 -0.881 . . . . 73.35 110.896 174.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.4 m -61.46 -31.84 71.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.949 0.405 . . . . 52.21 111.26 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.8 t -97.91 13.42 30.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.91 0.386 . . . . 71.53 111.103 -175.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.1 m -77.02 -34.59 57.38 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 111.854 0.316 . . . . 71.34 111.854 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.725 ' HD1' ' HG2' ' A' ' 53' ' ' GLU . 0.2 OUTLIER -143.33 -172.27 3.66 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.641 -0.424 . . . . 55.52 111.63 -179.551 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.725 ' HG2' ' HD1' ' A' ' 52' ' ' PHE . 16.9 pt-20 -108.31 -30.11 8.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.376 -0.829 . . . . 61.23 112.025 -170.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.451 ' HB ' ' OE1' ' A' ' 56' ' ' GLU . 47.1 p -127.87 155.28 44.4 Favored 'General case' 0 CA--C 1.513 -0.481 0 N-CA-C 109.715 -0.476 . . . . 65.32 109.715 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.1 ptmm? -72.03 -29.57 64.32 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.84 -0.344 . . . . 74.25 110.77 -177.157 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' OE1' ' HB ' ' A' ' 54' ' ' THR . 2.0 mp0 -60.92 -46.19 91.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.231 0.538 . . . . 74.14 110.186 177.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.695 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 24.6 mt-30 -81.58 -37.57 27.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.667 -0.697 . . . . 74.23 110.581 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.524 ' HE3' ' O ' ' A' ' 48' ' ' GLY . 16.5 ttt -63.17 -42.73 99.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.359 -0.382 . . . . 63.35 111.211 -179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 34.9 tt0 -64.69 -32.18 73.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.277 -0.419 . . . . 65.41 110.583 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.57 -12.34 60.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.149 0.5 . . . . 62.31 110.854 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.695 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.2 mmmt -106.53 11.1 31.0 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.208 -0.451 . . . . 64.31 109.979 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.608 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 15.4 ptpt -54.27 -49.37 69.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.012 -0.54 . . . . 71.54 110.064 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.608 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 11.4 tp60 -75.15 -26.97 59.55 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.98 -0.555 . . . . 71.43 110.239 -176.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 61' ' ' LYS . 25.0 mm-40 -58.85 -49.47 77.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.99 -0.55 . . . . 74.23 111.011 -178.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.464 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 3.4 ptt? -82.69 -34.86 27.2 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.067 0.46 . . . . 74.51 110.631 -177.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.531 ' HA ' ' CD2' ' A' ' 69' ' ' TYR . 67.1 mtp -77.08 -21.98 53.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.153 -0.476 . . . . 51.14 112.097 -174.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.464 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 25.6 t70 -58.95 -36.25 74.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.06 0.457 . . . . 71.24 111.365 -171.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.492 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 28.2 p90 -107.15 -6.11 17.55 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 71.52 111.534 -176.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.531 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 3.4 m-30 -58.56 -41.95 86.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.709 0.29 . . . . 73.11 110.943 -178.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.517 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -53.28 -52.35 59.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.078 -0.51 . . . . 64.52 110.665 174.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -90.48 65.98 6.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.915 -0.584 . . . . 71.13 110.958 -174.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 15.3 mmm-85 -130.98 -23.24 2.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.195 -0.457 . . . . 71.14 111.337 177.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.765 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -116.05 7.74 14.35 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.543 -0.463 . . . . 74.52 111.755 -178.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.3 pttm -76.2 -33.92 59.29 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.856 -0.738 . . . . 74.12 110.323 -173.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 1.6 pm0 -67.69 -25.17 65.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.278 0.561 . . . . 74.11 110.604 177.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.505 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 58.5 mtm -91.16 -18.95 23.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.818 -0.628 . . . . 71.22 109.971 178.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.487 HD13 ' CE ' ' B' ' 270' ' ' MET . 7.0 tt -82.39 -37.39 25.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.73 -0.668 . . . . 55.12 109.729 176.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.402 ' N ' ' HE1' ' B' ' 266' ' ' MET . 12.8 t70 -57.81 -37.56 73.99 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.256 0.551 . . . . 70.04 110.142 177.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.1 70.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.265 -0.879 . . . . 64.11 111.679 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -82.83 -23.09 33.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.016 0.436 . . . . 74.5 110.286 -178.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.484 ' O ' HG13 ' A' ' 85' ' ' ILE . 23.3 mmt -66.54 -50.28 63.67 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.81 -0.632 . . . . 60.13 110.123 175.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 44.7 mt-10 -55.77 -31.82 62.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.681 -0.69 . . . . 73.3 111.637 -177.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -53.7 -34.74 59.77 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.855 0.36 . . . . 74.44 111.04 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -104.72 -29.14 10.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.286 -0.415 . . . . 74.51 111.255 -178.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 81' ' ' MET . 58.5 mt -66.77 -64.53 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 111.653 0.242 . . . . 63.33 111.653 -178.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.513 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.3 pt-20 -65.41 -29.3 69.98 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.451 -0.5 . . . . 75.0 110.745 -177.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.4 ' ND2' ' HG3' ' A' ' 86' ' ' GLU . 52.1 m-80 -93.04 15.72 14.43 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.139 -0.482 . . . . 71.34 111.004 -177.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.577 ' CB ' ' HB3' ' B' ' 255' ' ' LYS . 24.7 t80 -54.46 -49.78 69.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.707 0.289 . . . . 74.01 110.985 178.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -61.91 -23.24 66.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 75.31 111.004 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -78.97 -50.9 10.38 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.804 -0.443 . . . . 72.53 109.804 177.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.523 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 73.3 m-85 -62.98 -42.63 99.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 74.12 111.018 178.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -69.77 -4.31 19.35 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.297 0.57 . . . . 72.34 110.817 -179.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -97.3 -29.57 13.47 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.142 -0.481 . . . . 65.41 110.43 177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 p -89.95 -35.23 15.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.04 -0.527 . . . . 50.32 110.331 178.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.523 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 0.0 OUTLIER -117.26 141.64 48.04 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.287 -0.635 . . . . 75.4 109.287 176.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 96' ' ' LYS . 44.4 mtmt . . . . . 0 C--N 1.321 -0.666 0 CA-C-N 116.183 -0.462 . . . . 62.44 110.611 -176.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 71.0 m . . . . . 0 C--O 1.234 0.269 0 CA-C-O 121.123 0.487 . . . . 62.15 111.105 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -131.27 -172.59 2.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.738 -0.664 . . . . 65.25 109.692 177.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.568 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.1 p-10 -101.18 156.39 17.46 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 120.665 0.269 . . . . 72.35 110.562 -179.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . 0.444 ' H ' ' HE2' ' B' ' 208' ' ' TYR . 26.0 mt-10 -82.76 -94.36 0.06 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.064 -0.516 . . . . 54.11 111.164 -177.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . 0.402 ' H ' ' HB2' ' B' ' 204' ' ' GLU . 12.7 t30 -103.32 -26.66 12.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.879 -0.6 . . . . 61.41 110.055 -177.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.568 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -110.0 153.29 24.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.581 -0.736 . . . . 64.44 110.475 176.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.652 ' HE1' ' HB3' ' A' ' 38' ' ' TRP . 0.1 OUTLIER -79.05 54.89 1.69 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.422 -0.808 . . . . 71.51 112.464 -177.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.444 ' HE2' ' H ' ' B' ' 204' ' ' GLU . 17.6 m-85 -50.95 -40.8 58.4 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.92 0.39 . . . . 75.22 111.379 -177.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.34 -27.53 66.0 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.479 -0.782 . . . . 71.52 112.696 -173.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 53.6 mtm-85 -91.88 -55.38 3.48 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.548 -0.461 . . . . 72.01 110.651 -179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.632 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.4 -22.64 44.31 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.814 0.672 . . . . 34.13 112.814 -177.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 7.0 t -67.04 -25.81 66.45 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.95 0.405 . . . . 54.44 110.51 -177.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -82.45 -29.22 30.79 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.345 0.593 . . . . 71.33 109.787 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.632 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -64.51 -45.35 87.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.076 -0.965 . . . . 72.5 109.392 177.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.588 HG23 ' HD2' ' A' ' 43' ' ' TYR . 82.0 mt -67.35 -33.03 60.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.564 -0.744 . . . . 71.11 110.452 176.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -35.59 73.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.683 -0.69 . . . . 63.43 111.286 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.535 HD12 HD13 ' A' ' 14' ' ' LEU . 3.1 tm? -64.57 -45.37 87.33 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.414 -0.587 . . . . 75.33 109.414 178.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.88 -31.84 68.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.764 -0.653 . . . . 74.35 111.164 -178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.504 ' O ' ' HG3' ' B' ' 223' ' ' GLN . 0.9 OUTLIER -61.08 -38.08 84.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.505 . . . . 71.12 110.919 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -67.68 -34.48 76.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.197 -0.456 . . . . 70.3 111.466 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -79.33 -23.07 43.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.445 0.64 . . . . 73.51 110.049 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -75.64 -16.25 60.23 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.266 -0.879 . . . . 74.21 110.267 178.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.504 ' HG3' ' O ' ' B' ' 219' ' ' ASN . 35.7 mt-30 -76.63 -4.11 41.29 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.211 -0.449 . . . . 73.22 111.201 -179.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.55 HD22 HG13 ' B' ' 227' ' ' ILE . 1.5 t30 -73.01 107.66 5.49 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.545 -0.539 . . . . 34.53 109.545 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.0 t -57.71 -35.71 71.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 113.017 0.747 . . . . 75.21 113.017 -171.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -85.32 1.55 47.93 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.508 0.559 . . . . 73.32 112.508 -177.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.55 HG13 HD22 ' B' ' 224' ' ' ASN . 5.1 mt -113.76 149.85 16.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.03 0.443 . . . . 61.31 110.326 177.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -92.53 160.22 15.14 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.853 -0.612 . . . . 65.22 109.875 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 6.8 m -63.02 -29.63 70.97 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.19 -0.459 . . . . 75.53 111.227 -176.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -67.38 -12.22 60.71 Favored Glycine 0 C--N 1.331 0.297 0 CA-C-N 115.901 -0.59 . . . . 73.42 113.339 -177.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.401 ' HB3' ' NH2' ' A' ' 10' ' ' ARG . 67.9 mm-40 -83.47 -25.79 30.84 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 122.342 -0.505 . . . . 74.41 110.524 178.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 19.9 t -85.35 -39.16 13.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.963 -0.562 . . . . 43.31 110.43 -177.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 11.2 p -59.06 -41.64 88.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.054 -0.521 . . . . 74.3 110.957 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -68.83 -32.1 71.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 74.44 111.016 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 49.9 m -65.43 -38.02 88.65 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.82 0.343 . . . . 43.44 110.279 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.672 ' HD1' HD12 ' A' ' 14' ' ' LEU . 11.9 t80 -66.36 -33.66 76.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.259 0.552 . . . . 64.22 109.831 178.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.765 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 9.3 ttm -69.18 -46.0 68.6 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.507 -0.769 . . . . 72.35 111.735 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.567 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 19.8 t-105 -64.59 -38.51 91.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.85 0.357 . . . . 74.01 110.645 177.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.5 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -61.82 -40.29 94.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.051 -0.522 . . . . 44.34 110.667 178.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.786 HD21 ' SD ' ' A' ' 37' ' ' MET . 45.3 tp -67.84 -32.6 73.24 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.257 -0.429 . . . . 71.44 110.831 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -62.42 -37.35 85.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 74.01 110.893 178.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -80.77 -30.69 36.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.133 -0.485 . . . . 72.32 110.888 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.512 ' HD2' HG23 ' A' ' 15' ' ' ILE . 6.6 t80 -82.07 -33.07 30.03 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.082 -0.508 . . . . 64.25 110.999 -175.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . 0.454 ' HB3' HD11 ' A' ' 77' ' ' LEU . 9.9 t-20 -78.28 -38.71 41.94 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.416 -0.356 . . . . 72.42 111.177 -176.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -63.8 -13.38 43.79 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.073 0.463 . . . . 42.25 111.482 -178.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -54.02 -36.37 62.93 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.511 -0.768 . . . . 70.5 110.258 175.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -78.36 -5.55 52.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.227 -0.442 . . . . 74.1 111.958 -177.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -65.67 -29.82 75.97 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.402 -0.904 . . . . 64.41 111.578 176.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 58.5 p -65.07 -34.95 79.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.995 0.426 . . . . 61.34 111.298 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.2 t -92.35 7.74 41.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.419 -0.355 . . . . 71.31 111.298 -176.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 71.2 m -74.41 -40.16 62.18 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 116.737 -0.211 . . . . 63.01 111.386 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.55 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 0.2 OUTLIER -151.41 -179.31 7.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.19 0.519 . . . . 74.01 111.731 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' B' ' 253' ' ' GLU . 7.9 pt-20 -94.42 -45.43 7.45 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.216 -0.902 . . . . 74.24 111.704 -173.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 41.2 p -106.1 157.87 17.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.369 -0.378 . . . . 70.13 110.227 -177.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.577 ' HB3' ' CB ' ' A' ' 88' ' ' PHE . 11.2 ptmm? -66.84 -33.28 75.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.88 0.372 . . . . 73.34 110.237 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -61.11 -50.39 73.42 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.61 -0.723 . . . . 74.23 110.738 -179.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 24.2 mt-30 -78.66 -31.88 46.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.981 -0.554 . . . . 60.02 110.845 -177.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.7 ttt -64.96 -43.77 91.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.133 0.492 . . . . 74.33 110.194 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 -63.09 -35.32 79.87 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.532 -0.758 . . . . 74.31 110.859 177.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -69.3 -11.5 60.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.222 -0.445 . . . . 60.15 111.197 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.59 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 30.2 mmmt -113.44 -1.19 14.24 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.499 -0.319 . . . . 73.11 110.51 -178.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.565 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 29.1 ttpp -55.4 -54.79 39.27 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.486 -0.324 . . . . 64.22 111.206 -176.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 16.9 tp60 -68.41 -26.72 65.68 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.973 -0.291 . . . . 71.14 110.74 -178.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -73.54 -37.88 65.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.524 -0.307 . . . . 72.42 111.285 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.565 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 17.9 ptp -79.85 -30.21 40.26 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.297 -1.001 . . . . 72.14 108.297 177.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.402 ' HE1' ' N ' ' A' ' 78' ' ' ASP . 58.5 mtp -90.5 29.77 1.24 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 114.981 -1.008 . . . . 74.12 110.638 177.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -111.03 -32.91 6.64 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 107.958 -1.126 . . . . 75.14 107.958 169.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -87.16 -33.72 19.3 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-N 114.576 -1.193 . . . . 72.51 112.617 -179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 22.1 m-30 -52.53 -52.52 54.39 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.987 -0.745 . . . . 74.45 108.987 177.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.517 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -65.45 -60.72 2.66 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.225 0.536 . . . . 70.41 110.829 174.263 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -88.82 62.96 6.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.811 -0.631 . . . . 72.33 112.04 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -147.76 -29.07 0.33 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.44 -0.345 . . . . 71.31 111.695 171.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.591 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -84.41 0.9 47.71 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 108.801 -0.814 . . . . 72.3 108.801 174.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -64.32 -53.87 42.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.414 -1.266 . . . . 74.25 110.676 -179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.25 -30.84 69.69 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.253 -0.43 . . . . 73.13 111.818 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . 0.493 ' HB3' ' CZ3' ' A' ' 38' ' ' TRP . 60.1 mtm -84.87 -26.66 27.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.84 0.352 . . . . 54.4 110.602 -179.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' B' ' 273' ' ' TYR . 3.7 tt -67.02 -33.92 76.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.016 -0.538 . . . . 73.43 109.784 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . 0.415 ' N ' ' HE1' ' A' ' 66' ' ' MET . 10.6 t70 -61.29 -44.18 97.65 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.837 -0.62 . . . . 64.23 110.831 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.34 65.27 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.391 -0.822 . . . . 65.23 111.159 -178.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . 0.448 ' CG ' ' HG2' ' A' ' 42' ' ' ARG . 86.1 m-20 -88.65 -15.91 33.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.046 -0.525 . . . . 73.44 110.344 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.404 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.5 mmt -75.5 -39.47 58.45 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.933 -0.576 . . . . 64.42 109.844 175.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 42.7 mt-10 -51.22 -39.59 56.9 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 115.374 -0.83 . . . . 73.4 111.934 -176.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -44.7 -47.81 10.66 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.939 0.774 . . . . 74.32 111.855 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -90.41 -29.86 17.75 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.249 -0.432 . . . . 73.24 111.017 -177.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.404 HG13 ' O ' ' B' ' 281' ' ' MET . 72.4 mt -64.37 -55.53 21.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 73.34 110.992 179.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.656 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.7 pt-20 -68.75 -17.63 64.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.283 -0.417 . . . . 54.44 111.664 -175.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -107.95 9.46 28.62 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 111.921 0.341 . . . . 73.02 111.921 -178.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -55.68 -45.73 77.73 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.792 0.329 . . . . 73.54 110.572 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -57.46 -33.52 68.05 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.848 -0.615 . . . . 71.41 110.978 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -77.43 -50.33 12.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.242 -0.435 . . . . 72.05 110.643 -177.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . 0.556 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 58.3 m-85 -60.57 -52.03 66.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.358 -0.383 . . . . 74.14 111.359 178.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.571 ' NH1' ' HA ' ' B' ' 296' ' ' LYS . 13.2 tpp180 -66.83 -13.42 61.55 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.093 0.473 . . . . 73.02 111.07 -177.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -83.86 -31.97 25.47 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.227 0.537 . . . . 51.23 110.532 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 4.1 p -95.47 -39.3 10.05 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.549 -0.751 . . . . 73.33 111.298 -176.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.556 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 0.0 OUTLIER -123.72 161.56 24.91 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.536 0.684 . . . . 64.12 112.056 -176.348 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . 0.571 ' HA ' ' NH1' ' B' ' 292' ' ' ARG . 44.0 mtmt . . . . . 0 C--O 1.246 0.918 0 CA-C-N 114.919 -1.037 . . . . 62.13 109.542 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 120.844 0.354 . . . . 71.11 110.826 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -71.89 148.58 45.95 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.33 -0.395 . . . . 73.2 111.067 -179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.599 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 1.7 p-10 -146.34 132.43 19.31 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.003 -0.544 . . . . 71.3 109.665 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -76.91 -89.06 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 63.54 110.642 179.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -111.3 -22.34 11.41 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.833 -0.621 . . . . 72.44 110.183 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -88.69 160.96 17.1 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.838 -0.619 . . . . 75.33 111.192 -178.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.456 ' HE1' ' HB3' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -85.41 49.98 1.86 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.236 -0.893 . . . . 63.43 111.769 -177.668 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.599 ' HD2' ' HB2' ' A' ' 3' ' ' ASN . 89.5 m-85 -52.19 -46.3 65.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.037 0.446 . . . . 74.35 111.321 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.53 -6.53 47.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 54.02 112.02 -174.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.558 ' NE ' ' HA ' ' A' ' 10' ' ' ARG . 4.1 mmp_? -96.37 -58.45 2.06 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 121.089 -0.244 . . . . 61.22 110.561 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.724 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -56.42 -20.35 19.29 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.626 0.602 . . . . 63.02 112.626 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 15.3 t -69.35 -23.34 63.75 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 121.03 -0.268 . . . . 71.44 111.334 -178.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.559 ' HB2' HD11 ' B' ' 217' ' ' LEU . 59.9 mt-10 -80.66 -28.63 36.77 Favored 'General case' 0 CA--C 1.52 -0.179 0 N-CA-C 109.271 -0.641 . . . . 71.03 109.271 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.724 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.4 mm? -64.41 -43.19 95.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.246 -0.888 . . . . 72.21 109.6 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 78.2 mt -69.46 -25.17 28.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.547 -0.751 . . . . 61.33 110.55 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.468 ' HA ' ' HD2' ' A' ' 16' ' ' LYS . 22.2 mmmt -61.75 -38.51 88.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.374 -0.375 . . . . 74.43 111.872 -179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.499 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.1 tm? -65.4 -34.23 77.81 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.235 -0.654 . . . . 75.52 109.235 179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.98 -35.94 69.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.584 -0.735 . . . . 74.33 110.393 -177.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -69.92 -12.3 61.52 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.969 -0.56 . . . . 62.25 111.531 -179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.29 -39.65 17.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.792 0.329 . . . . 74.25 110.692 175.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -76.35 -22.48 54.84 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.293 0.568 . . . . 64.11 110.259 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.417 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 4.3 t-20 -73.23 -11.82 60.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 74.23 110.553 -179.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -82.22 0.83 39.39 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 116.096 -0.502 . . . . 73.42 111.674 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.633 HD22 HG13 ' A' ' 27' ' ' ILE . 2.9 t30 -73.77 115.46 13.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.22 -0.659 . . . . 65.22 109.22 179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.0 t -50.18 -41.6 49.65 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.794 1.035 . . . . 63.34 113.794 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -97.5 2.44 50.2 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 113.111 0.782 . . . . 73.34 113.111 -171.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.633 HG13 HD22 ' A' ' 24' ' ' ASN . 7.7 mt -104.66 157.54 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 N-CA-C 109.568 -0.53 . . . . 73.45 109.568 178.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -96.45 167.61 11.05 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.555 -0.535 . . . . 74.21 109.555 178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.417 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 5.7 m -60.52 -32.12 71.16 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.016 0.436 . . . . 62.44 109.871 174.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.697 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -59.46 -38.21 93.19 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.258 -0.883 . . . . 63.41 113.714 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -64.91 -36.79 85.51 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.163 0.506 . . . . 72.13 110.439 -176.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 17.8 t -73.74 -39.14 52.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.866 -0.607 . . . . 70.03 110.199 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.8 m -59.56 -41.85 91.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.236 0.541 . . . . 71.02 110.248 177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.428 ' O ' ' HB3' ' A' ' 37' ' ' MET . . . -69.4 -29.92 67.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.641 -0.709 . . . . 71.53 110.938 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.2 m -65.18 -38.08 89.38 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.021 0.439 . . . . 72.21 109.911 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.842 ' HB3' HD13 ' B' ' 240' ' ' LEU . 1.6 t80 -67.99 -34.37 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.849 -0.614 . . . . 72.2 109.753 177.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.756 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 0.8 OUTLIER -61.71 -53.49 55.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.364 -0.834 . . . . 72.4 110.762 177.156 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.46 ' HE3' ' SD ' ' B' ' 276' ' ' MET . 24.2 t-105 -64.89 -40.24 94.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.082 -0.508 . . . . 74.23 111.012 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.53 -39.38 93.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.343 -0.39 . . . . 72.45 111.241 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 48.3 tp -61.98 -38.18 87.6 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 116.593 -0.276 . . . . 52.14 110.285 178.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.477 ' HA ' HD13 ' B' ' 277' ' ' LEU . . . -61.82 -46.07 91.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.356 -0.384 . . . . 43.21 110.711 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -66.86 -39.75 87.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.191 -0.459 . . . . 64.51 111.059 -177.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.711 ' HD2' HG23 ' B' ' 215' ' ' ILE . 11.0 t80 -76.94 -33.93 57.67 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.372 -0.377 . . . . 74.23 110.853 -176.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 9.8 t-20 -73.02 -43.3 62.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.217 -0.447 . . . . 75.14 110.759 -176.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.442 ' HB2' HD12 ' B' ' 277' ' ' LEU . . . -67.67 -18.61 65.0 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.175 -0.466 . . . . 71.53 111.335 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 21.1 t90 -59.01 -30.62 68.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.978 -0.555 . . . . 75.13 110.496 176.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -83.91 -10.11 58.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 73.11 111.282 179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -66.77 -24.02 72.64 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.466 -0.873 . . . . 75.1 111.383 176.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.646 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 79.3 p -69.92 -15.15 63.01 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.736 0.303 . . . . 63.11 111.355 -178.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 9.9 t -114.47 13.26 17.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.95 0.405 . . . . 61.35 110.855 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.3 m -72.04 -35.09 69.25 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 116.505 -0.316 . . . . 53.31 111.501 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.651 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.2 m-85 -147.92 178.74 8.26 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.409 0.623 . . . . 53.22 112.387 -178.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.593 ' HG3' HG23 ' A' ' 54' ' ' THR . 15.1 pt-20 -91.7 -34.58 14.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.766 -1.107 . . . . 72.35 110.798 -171.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.614 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 80.5 p -124.71 159.3 31.17 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.498 -0.774 . . . . 74.41 109.219 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.657 ' HA ' ' HB3' ' A' ' 58' ' ' MET . 6.6 pttm -78.67 -23.6 45.61 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 120.424 -0.51 . . . . 71.52 110.557 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.614 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.6 mp0 -61.34 -40.73 95.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.256 0.55 . . . . 63.32 109.808 178.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.768 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 21.1 mt-30 -83.52 -40.83 18.67 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.514 -0.766 . . . . 64.53 109.684 178.273 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.657 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 17.1 ttt -57.21 -44.55 83.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.755 -0.657 . . . . 72.41 111.605 179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.611 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.3 tt0 -59.95 -39.34 85.25 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.343 -0.389 . . . . 72.13 111.052 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.68 -0.09 19.51 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.998 -0.547 . . . . 73.14 111.24 -178.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.768 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.7 mmmt -112.47 -6.62 13.97 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.55 -0.295 . . . . 72.22 111.24 -177.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 34.2 pttt -63.87 -43.34 96.38 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 119.996 -0.682 . . . . 72.02 110.146 -176.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.579 ' O ' ' HB2' ' A' ' 67' ' ' ASP . 21.5 mm-40 -83.16 3.19 31.89 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-O 121.033 0.444 . . . . 73.24 111.168 177.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -97.47 -32.83 11.63 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.651 -0.704 . . . . 73.31 110.426 171.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.407 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 16.7 ptp -85.15 -35.26 21.84 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 108.682 -0.859 . . . . 52.43 108.682 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.575 ' HA ' ' HB2' ' A' ' 69' ' ' TYR . 69.0 mtp -80.64 -18.83 46.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.727 -0.669 . . . . 74.35 111.091 179.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.579 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 22.7 t70 -47.74 -45.75 29.29 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 123.672 0.608 . . . . 75.34 111.038 -178.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -108.15 -4.92 17.23 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.399 -0.819 . . . . 73.4 111.115 -176.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.628 ' HD2' HD21 ' B' ' 277' ' ' LEU . 1.8 m-30 -59.22 -48.26 82.28 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 121.305 -0.158 . . . . 73.41 111.05 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.567 ' HE1' HD23 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -54.08 -51.58 63.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.166 0.507 . . . . 54.43 110.206 175.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.466 ' OD2' ' HD2' ' A' ' 74' ' ' LYS . 1.9 t70 -90.7 22.74 3.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.65 -0.704 . . . . 74.24 111.291 -171.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.587 ' HB3' ' SD ' ' B' ' 237' ' ' MET . 3.2 mmm180 -84.71 -44.93 12.92 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.209 0.528 . . . . 70.24 110.251 -176.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.737 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -95.44 15.09 20.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.663 -0.699 . . . . 70.34 109.929 -179.107 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HD2' ' OD2' ' A' ' 71' ' ' ASP . 20.0 tttp -56.15 -61.87 2.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.377 -0.829 . . . . 73.11 110.345 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -67.38 -31.12 71.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.669 -0.696 . . . . 72.1 110.977 -178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.8 mtt -62.04 -38.86 90.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.349 0.595 . . . . 74.14 109.816 176.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.591 ' CD2' ' HE2' ' A' ' 81' ' ' MET . 1.6 tt -73.55 -42.28 61.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.298 -0.865 . . . . 73.23 109.499 -179.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.464 ' N ' ' HE3' ' B' ' 266' ' ' MET . 4.9 t70 -57.67 -42.04 82.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.447 -0.797 . . . . 72.32 110.831 177.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.59 -16.05 59.79 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.416 -0.811 . . . . 61.04 112.233 -178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -105.06 -16.07 14.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.844 0.354 . . . . 72.12 110.492 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.591 ' HE2' ' CD2' ' A' ' 77' ' ' LEU . 14.0 mmt -67.6 -63.02 1.14 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.906 -0.588 . . . . 64.32 111.55 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.632 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 8.3 pt-20 -80.6 1.85 28.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.835 0.68 . . . . 72.41 112.835 -170.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -59.39 -49.67 76.91 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.152 -0.684 . . . . 61.42 109.152 171.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -72.86 -38.26 67.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.482 -0.781 . . . . 70.24 110.189 176.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.735 HG21 ' HB2' ' B' ' 259' ' ' GLN . 66.7 mt -58.97 -54.25 36.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.523 -0.762 . . . . 73.14 111.941 -176.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.626 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.1 pt-20 -66.48 -12.15 55.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.652 0.263 . . . . 72.52 111.673 -177.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 46.0 m-80 -110.57 11.4 22.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.668 -0.242 . . . . 74.31 111.4 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.474 ' CE2' ' HA ' ' B' ' 254' ' ' THR . 8.5 t80 -52.71 -56.37 16.06 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.282 . . . . 74.34 110.294 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.29 -30.3 71.36 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.913 -0.585 . . . . 74.04 110.911 -179.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 -63.03 -58.93 5.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.101 -0.499 . . . . 73.22 110.133 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -65.63 -45.62 82.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.426 -0.352 . . . . 64.41 110.91 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.471 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 2.4 tmm_? -60.6 -23.96 65.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.987 -0.551 . . . . 61.14 110.44 -177.196 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.59 -39.78 62.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.149 -0.478 . . . . 61.43 110.654 -179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 35.7 p -79.61 -23.4 42.68 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.816 -0.629 . . . . 73.04 111.277 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -81.95 111.74 18.4 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.355 0.597 . . . . 71.05 110.951 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt . . . . . 0 C--N 1.317 -0.845 0 CA-C-N 115.306 -0.861 . . . . 72.43 110.365 -176.933 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 14.7 m . . . . . 0 C--O 1.234 0.256 0 CA-C-O 121.125 0.488 . . . . 74.11 110.46 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -142.06 164.23 30.72 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.029 -0.73 . . . . 52.35 109.029 178.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.417 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 1.8 p-10 -142.95 139.31 30.63 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 121.004 -0.278 . . . . 72.34 110.598 -178.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -68.92 -77.69 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.016 0.436 . . . . 75.5 110.162 175.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -128.51 -31.15 2.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.005 -0.543 . . . . 74.23 110.323 176.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -86.68 179.35 6.8 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.733 -0.667 . . . . 54.3 111.339 -177.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.54 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -79.68 43.93 0.6 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.433 -0.803 . . . . 75.42 112.674 -174.264 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -57.75 -43.39 85.37 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 111.667 0.247 . . . . 72.31 111.667 -177.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -69.96 -14.88 62.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.033 0.444 . . . . 53.12 111.447 -179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.54 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 1.4 mmp_? -91.0 -62.16 1.51 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.343 -0.39 . . . . 74.23 110.17 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.836 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -55.37 -25.77 37.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.699 0.629 . . . . 33.05 112.699 -177.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . 0.466 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 5.4 t -67.97 -21.16 65.09 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.764 0.316 . . . . 73.5 110.946 -178.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.409 ' HB2' HD11 ' A' ' 17' ' ' LEU . 50.7 mt-10 -84.64 -27.58 27.06 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.619 -0.511 . . . . 74.32 109.619 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.836 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -62.44 -41.32 98.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.514 -0.767 . . . . 73.51 109.43 176.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.711 HG23 ' HD2' ' A' ' 43' ' ' TYR . 87.5 mt -68.8 -22.83 26.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.204 -0.907 . . . . 73.21 111.027 178.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' B' ' 212' ' ' THR . 30.6 mmmt -66.58 -40.42 88.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.45 -0.341 . . . . 73.34 111.603 -177.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.559 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -62.47 -35.98 81.04 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.058 -0.719 . . . . 65.24 109.058 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . 0.425 ' O ' HG11 ' B' ' 232' ' ' VAL . . . -67.84 -37.42 81.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.731 -0.668 . . . . 54.24 110.145 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.412 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 29.2 m-80 -74.37 -6.49 48.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.99 -0.55 . . . . 72.1 111.509 179.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -93.98 -32.81 13.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.872 0.368 . . . . 73.43 110.789 175.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -75.78 -27.09 57.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.508 0.671 . . . . 74.12 109.689 175.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . 0.465 HD21 HG23 ' B' ' 229' ' ' THR . 3.5 t-20 -71.72 -12.76 61.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.985 -1.007 . . . . 74.41 110.481 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 86.9 mm-40 -75.22 -15.04 60.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.102 -0.499 . . . . 73.43 111.578 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.756 HD22 HG13 ' B' ' 227' ' ' ILE . 7.1 t30 -71.56 122.45 20.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.189 0.519 . . . . 54.25 109.719 -179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.2 t -65.66 -30.28 70.95 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.241 -0.89 . . . . 63.34 112.162 -174.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -97.14 -1.33 45.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.443 0.534 . . . . 71.33 112.443 -172.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.756 HG13 HD22 ' B' ' 224' ' ' ASN . 8.9 mt -99.2 148.63 6.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.358 -0.608 . . . . 53.4 109.358 175.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.813 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 42.7 mt-30 -78.21 147.38 34.47 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.859 -0.609 . . . . 75.23 109.865 178.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . 0.465 HG23 HD21 ' B' ' 222' ' ' ASN . 3.8 m -59.82 -34.63 73.31 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.041 0.448 . . . . 72.52 110.662 -178.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.28 87.68 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.861 -0.609 . . . . 75.25 113.816 -176.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.813 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 16.8 mm-40 -80.49 -29.52 37.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.842 0.821 . . . . 54.11 109.674 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . 0.425 HG11 ' O ' ' B' ' 218' ' ' ALA . 27.7 t -77.35 -41.34 29.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.27 -0.877 . . . . 71.11 110.938 -176.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 9.8 p -62.27 -40.16 95.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 72.11 110.816 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.45 75.39 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.899 -0.591 . . . . 74.15 110.934 179.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 64.0 m -65.06 -34.24 77.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 63.22 110.715 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.538 ' CD1' HD12 ' A' ' 14' ' ' LEU . 5.3 t80 -65.83 -36.65 84.07 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.309 0.576 . . . . 55.53 109.808 178.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.737 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.6 ttm -69.52 -48.39 60.68 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.751 -0.658 . . . . 64.03 111.547 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.456 ' HB3' ' HE1' ' A' ' 7' ' ' PHE . 34.9 t-105 -63.33 -35.04 79.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.327 . . . . 72.52 110.782 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.487 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.95 -40.49 95.09 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.333 -0.394 . . . . 75.12 110.894 177.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.842 HD13 ' HB3' ' A' ' 36' ' ' PHE . 43.8 tp -69.1 -32.13 71.33 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.979 0.418 . . . . 74.34 110.399 -178.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.447 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -63.06 -41.4 99.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.901 -0.591 . . . . 63.14 110.829 178.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 54.2 mtp180 -75.3 -26.65 58.88 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.15 0.5 . . . . 74.22 110.275 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -81.4 -36.52 29.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.716 -0.674 . . . . 55.02 110.854 -176.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -74.76 -27.82 60.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.659 0.266 . . . . 72.32 111.376 179.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.54 ' HA ' ' CE ' ' A' ' 81' ' ' MET . . . -71.98 -16.0 62.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.243 0.544 . . . . 61.5 111.105 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -55.88 -33.68 64.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 73.31 110.256 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.697 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 56.3 m-85 -71.63 -13.59 61.8 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.019 -0.537 . . . . 53.34 112.173 -177.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -60.47 -35.0 87.82 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.254 -0.974 . . . . 74.24 111.489 177.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.461 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 6.1 m -59.96 -30.96 69.44 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.814 0.34 . . . . 75.1 111.732 -177.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 9.0 t -102.26 16.86 24.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.056 0.455 . . . . 44.41 111.038 -176.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 22.9 t -78.01 -66.05 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.323 -0.399 . . . . 72.03 110.89 -178.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.626 ' CD1' ' HG3' ' B' ' 261' ' ' LYS . 2.4 m-85 -135.15 -169.99 2.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.293 0.568 . . . . 71.31 112.511 -174.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.733 ' HG3' ' H ' ' B' ' 254' ' ' THR . 5.4 pt-20 -95.82 -61.16 1.5 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.854 -1.066 . . . . 71.15 110.154 -177.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.733 ' H ' ' HG3' ' B' ' 253' ' ' GLU . 74.8 p -89.81 154.41 19.92 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 115.89 -0.596 . . . . 74.11 110.461 -177.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 10.4 ptmm? -71.5 -26.82 62.84 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.753 -0.379 . . . . 72.51 110.534 -177.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.8 -51.18 70.86 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.045 -0.525 . . . . 71.34 110.402 178.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.652 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 20.5 mt-30 -77.47 -40.72 42.11 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 63.42 110.063 -178.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.461 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 21.5 ttt -57.79 -40.66 80.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.433 -0.803 . . . . 52.32 111.179 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.735 ' HB2' HG21 ' A' ' 85' ' ' ILE . 30.1 tt0 -71.34 -29.44 64.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.224 -0.443 . . . . 74.21 111.44 -178.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -76.25 -15.54 59.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.011 0.434 . . . . 73.15 110.872 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 31.9 mmmt -95.66 -7.59 37.12 Favored 'General case' 0 CA--C 1.507 -0.689 0 CA-C-N 116.281 -0.418 . . . . 71.34 111.414 -174.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.566 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 56.6 pttt -58.14 -47.08 84.43 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.432 -0.349 . . . . 71.32 110.763 -174.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.553 ' O ' ' HB2' ' B' ' 267' ' ' ASP . 10.4 mm-40 -74.67 -16.05 60.78 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.461 -0.496 . . . . 70.41 111.623 -178.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -80.39 -32.59 37.53 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 120.779 -0.369 . . . . 74.5 110.407 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.566 ' HE3' ' HA ' ' B' ' 262' ' ' LYS . 15.3 ptp -89.73 -26.44 20.64 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.379 -0.6 . . . . 54.41 109.379 178.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.489 ' HG2' HD22 ' A' ' 77' ' ' LEU . 83.8 mtp -85.02 -20.68 30.1 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.788 -0.642 . . . . 25.35 111.615 -179.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . 0.553 ' HB2' ' O ' ' B' ' 263' ' ' GLN . 9.0 t70 -52.35 -47.64 65.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.485 0.66 . . . . 75.2 110.404 -175.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.45 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 8.8 p90 -96.83 0.12 48.78 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.316 -0.856 . . . . 72.51 110.858 -178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.465 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.2 m-30 -68.39 -50.52 52.4 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 108.702 -0.851 . . . . 74.05 108.702 171.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.502 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -53.36 -55.94 20.81 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.589 -0.732 . . . . 64.51 109.868 171.347 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -95.65 74.2 3.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.468 0.651 . . . . 64.13 111.385 -179.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 4.6 mtm180 -127.71 -38.41 1.89 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.862 -0.608 . . . . 71.51 109.819 168.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.756 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -97.84 11.78 36.16 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.157 -0.474 . . . . 73.02 110.874 -176.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -64.46 -53.14 52.92 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.679 -0.408 . . . . 74.43 110.811 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.55 -35.31 80.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.873 0.368 . . . . 62.31 110.866 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . 0.46 ' SD ' ' HE3' ' A' ' 38' ' ' TRP . 59.8 mtt -62.73 -43.65 98.25 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.628 0.727 . . . . 62.21 109.927 175.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.628 HD21 ' HD2' ' A' ' 69' ' ' TYR . 28.3 tp -70.25 -41.45 73.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.779 -1.101 . . . . 74.3 110.514 -178.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.14 -46.49 79.21 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.544 0.687 . . . . 52.41 110.102 178.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -70.08 -24.02 63.16 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.838 -1.073 . . . . 63.11 111.669 -177.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.41 -32.15 22.5 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.998 -0.281 . . . . 71.14 110.654 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.571 ' O ' HG13 ' B' ' 285' ' ' ILE . 24.9 mmt -60.55 -62.92 1.51 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.051 -0.522 . . . . 74.01 110.598 177.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.608 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 10.6 pt-20 -74.29 -7.27 52.19 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.857 -0.611 . . . . 74.33 112.154 -172.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -58.63 -48.04 82.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.149 0.5 . . . . 71.32 110.051 174.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -87.5 -15.63 37.04 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.308 -0.405 . . . . 73.55 111.197 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.611 HD13 ' HA ' ' A' ' 59' ' ' GLN . 57.5 mt -70.35 -55.95 12.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 C-N-CA 121.019 -0.272 . . . . 72.42 110.354 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.592 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.3 pt-20 -57.8 -30.49 65.75 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.81 0.338 . . . . 73.44 111.383 -178.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 61.9 m-80 -94.4 6.75 47.8 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.334 -0.394 . . . . 72.33 111.61 -177.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.629 ' O ' ' HB2' ' B' ' 292' ' ' ARG . 69.0 t80 -57.81 -44.71 86.56 Favored 'General case' 0 C--O 1.223 -0.328 0 N-CA-C 109.92 -0.4 . . . . 71.12 109.92 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -60.87 -32.67 72.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.921 0.391 . . . . 72.22 110.757 176.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -68.66 -53.77 20.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.01 -0.541 . . . . 65.2 110.052 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -64.4 -35.81 82.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 74.54 110.27 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.629 ' HB2' ' O ' ' B' ' 288' ' ' PHE . 0.1 OUTLIER -63.81 -27.84 69.45 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.565 -0.743 . . . . 75.1 110.265 177.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.17 -17.6 25.82 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.861 -0.609 . . . . 62.44 111.282 -176.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 20.4 p -94.32 -3.03 51.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.045 0.45 . . . . 41.54 111.189 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.417 ' O ' ' HD2' ' B' ' 296' ' ' LYS . 0.0 OUTLIER -116.36 153.36 32.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.024 -0.534 . . . . 72.51 110.552 179.279 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . 0.417 ' HD2' ' O ' ' B' ' 295' ' ' GLN . 30.2 mmmt . . . . . 0 C--O 1.249 1.027 0 CA-C-N 115.239 -0.891 . . . . 72.21 109.265 178.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.0 p . . . . . 0 N--CA 1.474 0.755 0 CA-C-O 120.636 0.255 . . . . 73.11 110.702 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -129.5 10.07 5.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.022 0.439 . . . . 64.04 111.077 -178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.56 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 4.4 p-10 -148.02 151.7 36.18 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.224 -0.444 . . . . 73.11 109.986 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -84.13 -77.29 0.27 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.58 -0.282 . . . . 52.11 111.253 -176.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -105.34 -50.73 3.16 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.276 0.56 . . . . 70.52 109.845 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.56 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -97.28 161.52 13.76 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.476 -0.784 . . . . 64.32 110.863 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HE1' ' CB ' ' B' ' 238' ' ' TRP . 0.1 OUTLIER -78.75 53.76 1.41 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.832 -0.622 . . . . 62.34 112.091 -179.121 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.444 ' CE1' ' HB3' ' A' ' 6' ' ' ALA . 28.6 m-85 -53.79 -41.32 67.13 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.973 0.416 . . . . 71.41 110.961 -178.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.93 -5.02 31.71 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.8 -0.636 . . . . 33.14 112.24 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -99.37 -61.99 1.3 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.771 -0.455 . . . . 72.42 109.771 176.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.32 -23.51 24.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.731 -0.668 . . . . 71.03 112.682 -178.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.0 t -65.26 -25.58 67.72 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.473 0.178 . . . . 71.25 111.06 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.537 ' HB2' HD11 ' B' ' 217' ' ' LEU . 36.8 mt-10 -82.16 -33.23 29.62 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.519 0.676 . . . . 63.45 109.183 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -63.73 -45.15 91.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.913 -1.04 . . . . 72.3 109.443 177.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.505 HG23 ' HD2' ' B' ' 243' ' ' TYR . 71.9 mt -68.91 -31.38 50.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.615 -0.72 . . . . 63.02 110.682 176.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -59.48 -38.59 81.24 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.19 -0.459 . . . . 72.21 110.828 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.627 ' HA ' ' HG2' ' A' ' 20' ' ' GLN . 2.0 tm? -67.63 -39.74 84.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 64.54 110.135 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.585 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -61.2 -25.52 67.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.255 0.55 . . . . 71.55 110.739 177.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.413 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 22.8 m-80 -80.51 -19.97 44.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.987 -0.551 . . . . 54.12 110.141 178.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.627 ' HG2' ' HA ' ' A' ' 17' ' ' LEU . 27.6 mm-40 -68.33 -51.38 45.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.411 0.624 . . . . 61.2 109.522 177.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -73.82 -14.69 61.14 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.159 -0.928 . . . . 74.31 110.362 -176.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -81.18 -11.64 59.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.744 -0.662 . . . . 62.34 110.854 -178.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 8.6 mm-40 -78.88 64.02 3.73 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.295 0.569 . . . . 73.22 110.352 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -147.55 149.36 32.43 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.502 -0.772 . . . . 74.51 109.053 -178.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 9.2 t -103.54 -31.77 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 111.979 0.362 . . . . 74.13 111.979 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -87.29 2.69 49.45 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.155 0.428 . . . . 73.3 112.155 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -113.92 148.93 16.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 109.8 -0.445 . . . . 71.03 109.8 176.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.519 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 2.3 mp0 -83.45 146.79 28.21 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.993 -0.548 . . . . 71.42 109.631 178.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 38.8 m -59.04 -34.79 72.32 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.125 0.488 . . . . 63.43 110.785 -177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.4 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -71.86 -11.57 73.94 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.746 -0.661 . . . . 54.24 113.32 -177.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.519 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 13.3 mm-40 -74.54 -23.31 58.78 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.297 0.57 . . . . 74.4 110.037 -179.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.585 HG11 ' O ' ' A' ' 18' ' ' ALA . 21.2 t -87.3 -39.08 12.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.636 -0.711 . . . . 53.53 109.834 177.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -57.56 -42.05 82.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.688 -0.687 . . . . 24.34 110.746 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.11 -31.28 72.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.023 -0.535 . . . . 73.44 110.908 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.536 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 50.0 m -66.96 -32.3 73.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.159 0.504 . . . . 74.41 109.901 -179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.495 ' CD1' HD12 ' B' ' 214' ' ' LEU . 7.1 t80 -68.47 -37.68 80.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.723 -0.671 . . . . 72.52 109.854 177.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.779 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 8.5 ttm -66.86 -45.22 78.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.761 -0.654 . . . . 65.33 111.324 178.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.661 ' CE3' ' HB3' ' B' ' 276' ' ' MET . 23.7 t-105 -63.1 -38.21 90.28 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.988 0.423 . . . . 71.22 110.565 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.509 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -66.39 -36.8 83.76 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.07 -0.514 . . . . 44.11 111.242 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' ASN . 61.4 tp -67.68 -35.52 79.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 109.946 -0.391 . . . . 72.54 109.946 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.424 ' O ' ' HG ' ' B' ' 277' ' ' LEU . . . -61.0 -43.59 98.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.81 -0.632 . . . . 73.21 110.9 178.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 65.6 mtp180 -69.88 -39.15 76.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.025 0.441 . . . . 75.13 110.708 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -72.41 -32.07 66.05 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.975 -0.557 . . . . 64.11 110.497 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 7.1 t-20 -77.31 -39.28 48.38 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.003 -0.544 . . . . 74.44 110.722 -177.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.74 -27.59 69.3 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.12 0.486 . . . . 74.32 111.006 179.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 18.6 t90 -58.55 -27.77 64.88 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.253 -0.885 . . . . 71.52 111.072 178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -79.83 -1.72 40.23 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.544 -0.298 . . . . 74.31 111.639 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -62.09 -27.53 69.06 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.463 -0.875 . . . . 72.3 111.37 175.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.58 ' HA ' ' HE3' ' A' ' 58' ' ' MET . 33.9 p -67.34 -17.7 64.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.926 0.393 . . . . 43.43 111.572 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 29.5 p -94.52 0.69 55.47 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.958 0.409 . . . . 54.44 110.894 -177.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.4 t -81.17 -39.03 26.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 63.11 111.59 -175.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.414 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.3 m-85 -154.13 -179.05 7.53 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.246 0.461 . . . . 73.24 112.246 -175.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.408 ' HG3' ' N ' ' A' ' 54' ' ' THR . 8.9 pt-20 -101.79 -47.32 4.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.41 -0.814 . . . . 75.13 111.284 -176.315 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.451 ' HB ' ' OE2' ' A' ' 56' ' ' GLU . 51.9 p -96.41 154.77 17.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.511 -0.313 . . . . 63.34 110.358 -178.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.506 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 17.1 ptmt -68.42 -31.16 70.3 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.844 -0.343 . . . . 71.44 110.287 -177.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.451 ' OE2' ' HB ' ' A' ' 54' ' ' THR . 1.7 mp0 -58.21 -52.24 66.39 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.281 0.562 . . . . 75.32 110.606 179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.681 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 21.8 mt-30 -76.91 -36.64 56.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.746 -0.661 . . . . 71.54 110.541 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.58 ' HE3' ' HA ' ' A' ' 49' ' ' SER . 22.7 ttt -64.86 -43.36 93.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.149 -0.478 . . . . 70.44 111.092 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.528 ' HG3' ' NZ ' ' A' ' 62' ' ' LYS . 32.5 tt0 -61.56 -38.68 88.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.021 -0.536 . . . . 74.23 111.406 -178.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.21 -8.7 57.11 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.056 -0.52 . . . . 73.4 111.714 -175.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.681 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 14.2 mmmm -104.02 -0.24 29.05 Favored 'General case' 0 CA--C 1.51 -0.568 0 C-N-CA 120.881 -0.328 . . . . 73.33 111.119 -175.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.592 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 6.6 ptpp? -59.52 -48.44 81.63 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.695 -0.402 . . . . 73.12 110.607 -176.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.592 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 13.1 tp60 -73.4 -24.52 60.3 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.961 -0.385 . . . . 64.32 109.961 -178.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -71.35 -43.45 66.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.843 -0.617 . . . . 73.31 111.19 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 22.2 ptp -75.19 -34.34 61.51 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.911 -0.774 . . . . 63.11 108.911 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.411 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 63.9 mtp -82.15 1.28 37.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.508 -0.769 . . . . 74.33 111.289 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 63' ' ' GLN . 26.1 t0 -78.86 -27.47 44.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.987 0.422 . . . . 75.33 110.512 -175.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.631 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 24.6 p90 -119.38 -8.59 10.03 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.652 -0.419 . . . . 73.1 111.258 179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 2.2 m-30 -54.57 -48.34 72.2 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.625 0.25 . . . . 75.4 111.472 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.782 ' HA ' ' HE1' ' B' ' 273' ' ' TYR . 0.0 OUTLIER -52.3 -57.54 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.994 -0.548 . . . . 74.45 111.54 177.875 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.493 ' HA ' ' HG2' ' B' ' 270' ' ' MET . 9.1 t70 -91.47 62.74 4.66 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.952 -0.567 . . . . 61.51 111.066 -172.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.631 ' HG2' ' O ' ' A' ' 68' ' ' TYR . 4.2 mmp_? -120.12 -38.01 2.99 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 73.25 110.923 175.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.822 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -90.22 12.2 18.8 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.129 0.49 . . . . 73.02 109.726 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -51.81 -66.86 0.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.834 -1.076 . . . . 62.11 111.098 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -69.0 -23.16 64.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.75 -0.659 . . . . 70.25 112.266 -174.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.434 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 28.2 mtm -78.13 -28.14 48.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.297 0.57 . . . . 71.21 109.619 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.751 HD21 ' HE2' ' A' ' 81' ' ' MET . 6.6 tt -76.08 -37.59 58.01 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.438 -0.801 . . . . 74.3 108.887 174.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.424 ' HB2' ' HE1' ' B' ' 266' ' ' MET . 11.3 t70 -55.76 -39.33 71.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.055 -0.975 . . . . 71.42 111.069 178.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.96 -20.32 66.16 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.283 -0.871 . . . . 70.53 111.974 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -104.3 -4.47 22.9 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 121.065 -0.254 . . . . 54.33 111.382 -175.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.751 ' HE2' HD21 ' A' ' 77' ' ' LEU . 9.5 mmt -71.56 -35.41 70.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.637 -0.256 . . . . 64.21 111.611 -178.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.895 ' HA ' HD12 ' A' ' 85' ' ' ILE . 41.2 mt-10 -72.58 4.03 4.34 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 112.003 0.371 . . . . 74.22 112.003 -177.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.537 ' O ' ' HB2' ' A' ' 84' ' ' TYR . 0.5 OUTLIER -65.34 127.2 30.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 109.401 -0.592 . . . . 51.43 109.401 170.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.537 ' HB2' ' O ' ' A' ' 83' ' ' ASP . 23.0 m-85 77.5 -0.12 2.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 114.83 -1.077 . . . . 63.13 110.997 -179.214 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.895 HD12 ' HA ' ' A' ' 82' ' ' GLU . 11.2 mt -92.68 -66.02 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.108 -0.496 . . . . 65.51 109.687 176.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.26 -18.54 65.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.269 0.557 . . . . 63.23 110.151 176.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -100.8 0.6 39.02 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.617 -0.72 . . . . 71.22 111.152 -179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -59.76 -47.6 85.03 Favored 'General case' 0 C--O 1.226 -0.165 0 CA-C-O 120.589 0.233 . . . . 75.54 110.614 -177.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -56.41 -24.11 42.81 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.984 -0.553 . . . . 62.11 111.412 178.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -85.3 -55.03 4.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.198 -0.456 . . . . 74.23 109.924 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -61.42 -40.82 95.83 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.798 0.332 . . . . 72.51 111.36 -179.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.481 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 6.3 tmm_? -65.84 -17.2 64.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.883 -0.599 . . . . 53.05 109.809 -178.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -95.04 -39.87 9.94 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.959 -0.564 . . . . 64.42 110.572 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' A' ' 96' ' ' LYS . 41.5 p -83.59 -1.61 54.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.804 -0.634 . . . . 62.22 112.228 -176.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -59.87 139.51 57.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.132 0.492 . . . . 73.13 110.558 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 94' ' ' THR . 95.8 mttt . . . . . 0 C--N 1.321 -0.647 0 CA-C-N 115.829 -0.623 . . . . 74.12 110.506 -175.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 18.7 m . . . . . 0 C--O 1.231 0.129 0 CA-C-O 121.198 0.523 . . . . 72.43 109.987 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -90.97 19.08 5.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.498 0.666 . . . . 64.2 109.266 173.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.592 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 84.4 m-20 -111.2 179.33 4.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.105 -0.952 . . . . 72.24 111.482 -172.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -120.68 -58.69 1.81 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.32 -0.855 . . . . 75.24 109.677 176.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -122.03 -49.06 2.09 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.104 0.478 . . . . 63.0 110.28 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -99.85 166.63 10.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.798 -0.637 . . . . 55.54 111.74 -177.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.592 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -78.84 53.99 1.47 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 74.04 111.708 178.126 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.408 ' CZ ' ' HB3' ' B' ' 206' ' ' ALA . 71.1 m-85 -54.49 -45.6 73.28 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.205 -0.452 . . . . 72.21 111.753 -176.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.5 -15.34 62.56 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 112.431 0.53 . . . . 62.3 112.431 -176.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -87.74 -62.33 1.52 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.576 0.227 . . . . 75.13 110.506 176.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.836 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.6 -18.91 22.45 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.877 0.695 . . . . 65.42 112.877 -176.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 13.6 t -66.76 -23.16 66.04 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.695 0.284 . . . . 73.02 110.738 179.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.493 ' HB2' HD11 ' A' ' 17' ' ' LEU . 79.4 mt-10 -84.55 -27.46 27.31 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 121.387 0.613 . . . . 71.53 109.379 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.836 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -67.23 -47.27 71.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.202 -0.908 . . . . 62.41 109.598 178.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 74.6 mt -68.9 -30.92 48.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.661 -0.699 . . . . 65.3 110.27 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' B' ' 212' ' ' THR . 10.2 tmtt? -56.31 -40.03 73.69 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.796 -0.638 . . . . 72.12 110.88 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.8 tm? -64.61 -45.21 87.9 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.576 -0.527 . . . . 73.41 109.576 178.59 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -59.85 -37.08 78.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.98 -0.555 . . . . 71.1 110.835 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -74.52 11.56 0.98 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.053 -0.521 . . . . 71.22 111.757 178.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.11 -37.72 6.51 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.16 0.505 . . . . 72.25 109.733 168.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -76.83 -38.32 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.771 -0.65 . . . . 71.54 110.835 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . 0.557 ' ND2' ' HA ' ' B' ' 229' ' ' THR . 3.8 t-20 -71.29 -14.59 62.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.63 -0.714 . . . . 71.22 111.55 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -74.71 1.22 12.87 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.453 -0.34 . . . . 60.44 111.315 -176.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.533 HD22 HG13 ' B' ' 227' ' ' ILE . 1.4 t30 -77.69 103.95 7.94 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.61 -0.885 . . . . 72.2 108.61 174.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 5.9 t -58.64 -36.66 74.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.594 -0.73 . . . . 72.11 112.888 -172.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -82.57 9.55 9.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.964 0.357 . . . . 74.32 111.964 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.533 HG13 HD22 ' B' ' 224' ' ' ASN . 4.5 mt -117.28 152.98 19.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 109.768 -0.456 . . . . 72.32 109.768 175.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -80.0 154.43 28.21 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.087 -0.506 . . . . 71.24 110.169 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . 0.557 ' HA ' ' ND2' ' B' ' 222' ' ' ASN . 5.5 m -64.43 -30.81 71.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.978 0.418 . . . . 65.05 110.501 179.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -68.05 -18.15 70.58 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 115.825 -0.625 . . . . 35.32 113.318 -178.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -71.23 -20.21 62.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.991 0.424 . . . . 72.05 111.078 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . 0.455 HG21 ' CA ' ' B' ' 222' ' ' ASN . 28.6 t -99.12 -36.76 5.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.085 -0.507 . . . . 70.45 110.478 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 35.9 p -64.16 -40.99 97.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.03 0.443 . . . . 64.31 110.52 179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -64.51 -32.38 73.99 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 115.989 -0.55 . . . . 61.44 110.554 177.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.405 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 56.4 m -68.12 -36.49 79.82 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 109.744 -0.465 . . . . 54.0 109.744 179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.523 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.7 t80 -67.53 -40.73 85.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.751 -0.659 . . . . 75.45 109.58 177.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.822 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 14.8 ttm -66.25 -44.13 84.58 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.685 -0.689 . . . . 64.13 111.457 178.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.444 ' CB ' ' HE1' ' A' ' 7' ' ' PHE . 22.7 t-105 -64.31 -38.91 92.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 72.33 110.445 176.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.514 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -64.7 -39.08 93.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.131 -0.486 . . . . 74.2 111.065 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.17 -35.83 78.65 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 109.615 -0.513 . . . . 74.41 109.615 177.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -62.88 -30.65 71.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.175 -0.466 . . . . 61.44 111.406 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -88.59 -33.25 17.74 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.871 -0.332 . . . . 74.04 110.949 179.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.505 ' HD2' HG23 ' A' ' 15' ' ' ILE . 10.7 t80 -81.56 -39.64 24.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.392 -0.367 . . . . 72.4 111.233 -175.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -78.82 -17.43 55.7 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.047 0.451 . . . . 73.13 110.975 -175.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -74.75 -13.95 60.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.233 0.539 . . . . 70.13 110.57 177.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 73.7 t90 -60.63 -25.93 66.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.513 -0.767 . . . . 65.22 110.533 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.4 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 63.4 m-85 -72.77 -8.63 56.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.862 -0.608 . . . . 73.45 111.762 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . 0.747 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -56.03 -36.4 67.34 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.508 -0.853 . . . . 74.22 111.816 177.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 43.9 p -69.8 -13.63 62.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.815 0.34 . . . . 72.5 111.831 -177.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 40.0 p -93.03 -9.82 38.4 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.39 . . . . 72.41 110.784 -178.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.7 t -76.5 -36.56 57.73 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.244 -0.435 . . . . 51.53 110.772 -175.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.403 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 1.4 m-85 -148.88 -178.5 6.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.126 0.489 . . . . 72.01 111.919 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.527 ' HG3' HG23 ' B' ' 254' ' ' THR . 10.3 pt-20 -103.93 -33.41 8.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.136 -0.938 . . . . 74.31 111.779 -172.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.536 ' HB ' ' OE1' ' B' ' 256' ' ' GLU . 43.2 p -115.09 158.48 22.09 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.869 -0.605 . . . . 75.45 110.158 -178.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -67.77 -36.06 79.81 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 121.052 -0.259 . . . . 63.24 110.792 -178.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . 0.536 ' OE1' ' HB ' ' B' ' 254' ' ' THR . 1.6 mp0 -58.27 -50.97 71.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.282 0.563 . . . . 73.25 110.188 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.618 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 23.9 mt-30 -73.05 -40.86 64.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.471 -0.786 . . . . 75.21 110.82 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.448 ' SD ' HG12 ' A' ' 85' ' ' ILE . 20.1 ttt -63.88 -47.38 80.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.271 -0.422 . . . . 74.32 111.24 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.547 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.7 tt0 -62.0 -34.48 76.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.238 -0.437 . . . . 63.24 110.909 -178.191 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -73.32 -6.77 48.24 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.113 -0.494 . . . . 45.24 111.58 -178.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.618 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 13.9 mmmm -114.59 5.49 15.47 Favored 'General case' 0 CA--C 1.513 -0.449 0 O-C-N 122.362 -0.211 . . . . 53.02 110.608 -179.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.473 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 1.6 ptpp? -52.55 -48.34 66.19 Favored 'General case' 0 N--CA 1.454 -0.237 0 O-C-N 123.314 0.384 . . . . 64.41 110.785 -177.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 16.1 tp60 -77.78 -28.36 50.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 120.99 0.424 . . . . 62.41 110.055 -178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -67.67 -38.17 83.38 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.748 -0.66 . . . . 61.1 111.187 -177.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.747 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 16.8 ptp -84.44 -26.19 28.42 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 121.307 0.575 . . . . 74.11 109.83 -177.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.523 ' HG2' HD22 ' A' ' 77' ' ' LEU . 75.0 mtp -79.1 -20.46 48.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.643 -0.708 . . . . 70.14 111.758 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -60.41 -34.95 74.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.824 0.345 . . . . 75.2 111.369 -168.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.6 p90 -102.79 -10.61 18.97 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.787 -0.365 . . . . 74.44 111.179 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -60.35 -48.13 83.08 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.477 0.18 . . . . 51.4 111.173 -178.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.81 ' HA ' ' HE1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -51.65 -51.77 53.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.059 -0.519 . . . . 75.52 111.088 177.067 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . 0.662 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 10.4 t70 -92.2 28.75 1.81 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.831 -0.622 . . . . 45.11 111.558 -171.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -84.28 -48.28 9.91 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.945 -0.472 . . . . 73.54 110.765 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.782 ' HE1' ' HA ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -83.85 10.49 9.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.113 -0.494 . . . . 74.51 110.981 -174.822 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 70' ' ' MET . 14.4 tttp -56.07 -60.57 3.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.946 -0.57 . . . . 73.43 110.782 -177.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . 0.473 ' HG3' ' N ' ' B' ' 276' ' ' MET . 6.0 pt-20 -56.82 -39.83 74.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.602 -0.726 . . . . 74.12 111.842 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . 0.661 ' HB3' ' CE3' ' A' ' 38' ' ' TRP . 49.3 mtm -74.66 -26.21 59.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.044 0.45 . . . . 44.12 110.548 -176.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 41' ' ' ALA . 5.2 tt -72.41 -41.69 65.96 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.711 -0.848 . . . . 75.55 108.711 175.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . 0.411 ' N ' ' HE1' ' A' ' 66' ' ' MET . 8.7 t70 -61.37 -38.68 87.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.237 -0.892 . . . . 71.02 110.815 177.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -64.39 -17.35 63.67 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.656 -0.702 . . . . 35.2 111.779 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -101.09 -3.37 29.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.758 0.313 . . . . 71.53 111.283 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.41 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.1 mmt -76.38 -176.03 3.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.242 -0.435 . . . . 73.42 110.675 176.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.769 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 4.0 mm-40 61.54 14.81 6.22 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.483 -0.78 . . . . 75.11 111.901 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 20.0 p-10 -66.76 -58.84 4.27 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.201 -0.454 . . . . 63.54 110.676 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -89.29 -7.46 55.35 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.977 0.417 . . . . 72.54 110.002 174.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.769 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 42.7 mt -75.44 -57.88 5.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.087 -0.506 . . . . 74.32 111.318 -175.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.655 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.5 pt-20 -73.03 -16.71 61.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.838 0.351 . . . . 72.24 110.595 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . 0.403 ' ND2' ' HG3' ' B' ' 286' ' ' GLU . 56.4 m-80 -109.19 22.19 16.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.289 -0.414 . . . . 64.43 110.516 -179.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.506 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 25.3 t80 -58.6 -56.78 17.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.47 -0.332 . . . . 75.33 110.826 -178.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -60.42 -21.19 61.96 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.536 -0.302 . . . . 73.52 111.364 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -69.77 -57.61 4.9 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.778 -0.452 . . . . 73.13 109.778 178.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -70.67 -28.61 64.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.067 -0.515 . . . . 71.02 110.495 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.468 ' O ' ' HD2' ' B' ' 292' ' ' ARG . 7.8 tmm_? -72.0 -15.09 62.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.455 -0.793 . . . . 70.51 110.03 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -91.08 -39.05 12.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.042 0.449 . . . . 71.32 110.264 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 39.7 p -94.14 22.84 5.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.879 -0.6 . . . . 73.32 111.197 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -72.55 135.27 45.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.766 -0.652 . . . . 63.4 110.602 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 96.0 mttt . . . . . 0 C--N 1.314 -0.964 0 CA-C-O 118.296 -0.859 . . . . 74.2 109.757 -178.976 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 120.619 0.247 . . . . 74.11 110.36 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -81.39 -12.51 58.94 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.041 0.448 . . . . 53.0 110.233 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.697 ' HA ' ' HB2' ' A' ' 8' ' ' TYR . 1.6 p-10 -148.65 121.12 8.5 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.759 -0.83 . . . . 74.31 108.759 170.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.461 ' H ' ' HD2' ' A' ' 8' ' ' TYR . 24.8 mt-10 -104.33 79.08 1.55 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.25 -0.432 . . . . 62.03 111.544 -175.01 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 67.43 24.67 8.77 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.125 0.965 . . . . 75.22 108.735 175.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -158.3 174.91 14.44 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.41 -1.268 . . . . 71.03 110.222 -171.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -91.49 42.4 1.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.308 -0.405 . . . . 64.31 111.526 -177.623 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.697 ' HB2' ' HA ' ' A' ' 3' ' ' ASN . 44.5 m-85 -53.34 -46.3 69.46 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.413 -0.358 . . . . 54.13 111.193 178.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.12 -14.91 62.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.95 -0.568 . . . . 51.01 111.914 -178.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.444 ' HB2' ' HB2' ' A' ' 7' ' ' PHE . 0.6 OUTLIER -95.36 -58.02 2.25 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.257 -0.275 . . . . 72.42 110.257 178.905 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.889 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -57.16 -23.14 45.44 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.688 0.625 . . . . 51.53 112.688 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.2 t -65.39 -24.01 67.11 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.941 0.401 . . . . 70.04 110.801 179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.544 ' HB2' HD11 ' B' ' 217' ' ' LEU . 35.9 mt-10 -81.34 -23.28 37.86 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.332 0.586 . . . . 73.21 109.878 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.889 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.3 mm? -71.14 -41.68 70.14 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.333 -0.848 . . . . 75.03 109.591 179.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.425 HG23 ' HD2' ' B' ' 243' ' ' TYR . 71.4 mt -72.67 -20.58 19.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.657 -0.701 . . . . 75.31 110.192 177.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.538 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 15.7 mmmt -57.96 -40.08 79.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.708 -0.678 . . . . 70.31 111.851 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' B' ' 213' ' ' GLU . 2.7 tm? -74.98 -29.73 60.98 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.267 0.556 . . . . 72.44 109.527 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.418 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -70.4 -42.95 71.02 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.585 -0.734 . . . . 51.5 110.698 -175.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.655 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 93.8 m-20 -57.05 -42.45 80.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.893 -0.594 . . . . 64.11 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -61.92 -33.96 75.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.939 -0.573 . . . . 75.52 111.745 -179.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -77.62 -27.99 51.31 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.001 0.429 . . . . 74.14 110.199 178.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.595 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 3.4 t-20 -74.7 -20.28 59.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.94 -0.573 . . . . 74.14 110.383 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.655 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 9.9 mm-40 -71.91 -15.58 62.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.962 -0.563 . . . . 64.22 111.296 -178.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.616 ' HB3' HG13 ' A' ' 27' ' ' ILE . 10.7 t30 -66.69 123.51 20.29 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.963 0.411 . . . . 61.45 110.569 -177.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.2 t -56.98 -37.2 71.28 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.368 -0.833 . . . . 74.24 113.039 -175.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -82.74 -24.09 33.71 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.852 0.316 . . . . 75.0 111.852 -173.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.616 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.5 mt -90.68 145.11 7.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.095 0.474 . . . . 70.12 110.276 -174.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.708 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 33.4 mt-30 -83.73 152.65 24.59 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 115.322 -0.854 . . . . 71.32 109.358 177.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.595 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 30.2 m -58.3 -37.7 75.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.033 0.445 . . . . 72.0 110.437 179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.844 ' HA2' ' HZ ' ' B' ' 247' ' ' PHE . . . -69.39 -19.08 74.08 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.6 -0.727 . . . . 72.25 114.078 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.708 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 33.7 mm-40 -74.92 -36.09 62.17 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 117.588 0.694 . . . . 71.31 109.606 -178.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.498 HG21 ' HA ' ' A' ' 22' ' ' ASN . 39.5 t -71.92 -41.04 69.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.312 -0.858 . . . . 74.21 110.353 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.3 m -59.38 -37.08 77.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.714 -0.675 . . . . 73.21 110.369 178.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.64 -31.48 65.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.798 -0.637 . . . . 72.01 110.872 179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.483 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 10.3 t -68.33 -37.54 80.64 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 109.694 -0.484 . . . . 72.0 109.694 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.616 ' HD1' HD12 ' B' ' 214' ' ' LEU . 13.7 t80 -66.89 -37.47 84.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 72.11 109.545 176.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.731 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.4 ttm -67.33 -46.63 72.91 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.597 -0.728 . . . . 61.02 111.412 178.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.631 ' HE3' ' HB3' ' B' ' 276' ' ' MET . 35.8 t-105 -62.24 -39.93 94.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.739 0.304 . . . . 72.32 110.727 177.469 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.522 ' HB2' ' HB1' ' B' ' 211' ' ' ALA . . . -63.14 -37.89 88.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.362 -0.381 . . . . 72.1 111.038 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.753 HD21 ' SD ' ' B' ' 237' ' ' MET . 56.4 tp -64.94 -37.93 89.29 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-O 120.955 0.407 . . . . 70.5 110.075 178.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.549 ' HB1' ' HA ' ' B' ' 277' ' ' LEU . . . -63.16 -35.41 80.21 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.797 -0.638 . . . . 74.43 111.25 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 38' ' ' TRP . 55.9 mtp180 -74.81 -37.45 62.34 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.258 0.551 . . . . 74.12 110.142 -179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -77.39 -41.25 40.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.471 -0.786 . . . . 75.53 110.911 -175.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -66.05 -34.74 78.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.945 -0.57 . . . . 52.41 110.862 -175.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.403 ' HB1' ' HG2' ' B' ' 281' ' ' MET . . . -62.37 -11.07 13.44 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.851 -0.613 . . . . 71.21 112.471 -177.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -63.27 -26.99 69.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.666 0.27 . . . . 73.33 111.087 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -66.53 -11.87 54.83 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.446 -0.343 . . . . 65.22 111.856 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -60.48 -28.01 66.78 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.274 -0.965 . . . . 75.43 111.233 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.9 m -64.17 -15.83 60.67 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.474 0.31 . . . . 73.54 111.657 -179.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 12.9 t -119.15 22.19 11.95 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.153 0.501 . . . . 72.14 110.698 178.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.1 t -84.59 -60.88 1.93 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.45 -0.341 . . . . 74.33 110.814 178.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.536 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.8 m-85 -146.48 -175.29 4.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.814 0.34 . . . . 75.32 111.387 -177.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -102.1 -33.13 9.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.575 -0.739 . . . . 61.03 111.241 -174.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 31.6 p -113.01 153.02 28.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.897 -0.592 . . . . 73.01 110.804 -178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -67.37 -34.04 76.45 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.403 -0.362 . . . . 64.1 110.755 -177.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.23 -36.44 84.15 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.247 -0.433 . . . . 53.04 111.001 -179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.663 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 mt-30 -84.84 -40.16 17.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.448 -0.342 . . . . 62.35 110.468 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' HG12 ' B' ' 285' ' ' ILE . 19.4 ttt -64.4 -45.1 89.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.234 -0.439 . . . . 73.01 111.425 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.603 ' HB2' HG21 ' B' ' 285' ' ' ILE . 36.2 tt0 -64.25 -33.44 75.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 63.33 110.993 -178.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.47 -17.84 62.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.238 -0.437 . . . . 74.33 110.898 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.663 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 30.3 mmmt -100.44 -2.3 33.62 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.262 -0.426 . . . . 54.22 109.904 -176.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.594 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 27.2 ttpp -53.54 -51.77 61.84 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 116.239 -0.437 . . . . 41.41 111.31 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -80.41 -11.22 59.72 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 120.318 -0.553 . . . . 65.32 110.45 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -83.49 -27.78 29.18 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.312 -0.404 . . . . 74.21 110.012 176.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.594 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 19.0 ptp -88.9 -33.23 17.38 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.353 -0.981 . . . . 71.45 108.353 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . . . . . . . . . 61.6 mtp -85.56 14.66 5.34 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-N 115.402 -0.817 . . . . 74.14 111.144 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -87.37 -39.57 15.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.182 0.515 . . . . 54.22 110.321 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.646 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 39.2 p90 -103.59 -9.89 18.87 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.098 -0.501 . . . . 73.42 111.758 -173.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.416 ' O ' ' HE1' ' B' ' 237' ' ' MET . 11.6 m-30 -56.74 -48.94 76.67 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.864 0.364 . . . . 63.44 110.902 -179.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.869 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -54.24 -47.03 72.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.53 0.681 . . . . 74.41 110.101 176.459 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -82.93 34.49 0.45 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.017 -0.992 . . . . 73.15 110.975 -175.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.682 ' NE ' ' HA ' ' A' ' 72' ' ' ARG . 2.1 mmp_? -107.76 -32.57 7.57 Favored 'General case' 0 C--N 1.327 -0.399 0 O-C-N 121.982 -0.449 . . . . 75.23 110.995 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.805 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -107.08 3.61 26.04 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.348 -0.541 . . . . 72.13 110.027 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.433 ' HB2' ' HG2' ' B' ' 270' ' ' MET . 82.2 tttt -63.96 -54.04 40.82 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.025 -0.534 . . . . 53.4 110.748 -178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -62.6 -24.79 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.906 -0.588 . . . . 63.54 111.499 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.613 ' HB3' ' CE3' ' B' ' 238' ' ' TRP . 64.1 mtm -90.89 -23.0 20.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.022 0.439 . . . . 73.12 110.456 -179.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.421 HD13 ' HE1' ' B' ' 270' ' ' MET . 6.2 tt -73.16 -38.65 66.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.755 -0.832 . . . . 72.1 108.755 176.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.439 ' N ' ' HE1' ' B' ' 266' ' ' MET . 26.8 t70 -60.32 -31.88 70.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.321 -0.854 . . . . 72.15 110.588 178.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -74.59 -14.29 60.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.602 -0.726 . . . . 62.1 111.621 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 34.3 m-80 -97.44 -9.96 26.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.224 0.535 . . . . 71.13 110.641 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.45 -169.64 1.05 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.891 -0.595 . . . . 74.34 110.276 174.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.556 ' HA ' HD12 ' A' ' 85' ' ' ILE . 5.1 mm-40 64.17 -11.03 0.13 Allowed 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.876 1.065 . . . . 64.32 113.876 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -53.57 -62.64 1.52 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.735 0.302 . . . . 52.33 111.457 -178.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 84.5 m-85 -81.99 5.68 18.47 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.756 0.313 . . . . 72.51 111.019 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.595 HG21 ' HB2' ' B' ' 259' ' ' GLN . 51.6 mt -97.74 -59.7 3.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.42 -0.354 . . . . 73.53 111.258 -175.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.4 pt-20 -71.88 -18.49 62.04 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.567 -0.453 . . . . 73.44 110.884 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 45.3 m-80 -97.37 1.39 49.3 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.278 -0.419 . . . . 64.24 110.481 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -63.01 -38.43 91.18 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.658 -0.497 . . . . 70.32 109.658 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -53.63 -35.86 61.4 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.622 -0.717 . . . . 64.51 110.432 174.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -76.95 -53.24 8.09 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.582 -0.735 . . . . 72.54 110.317 -179.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -58.22 -46.78 85.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.152 -0.477 . . . . 74.22 111.41 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 6.2 tpp180 -67.86 -14.98 63.4 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.957 -0.565 . . . . 75.45 110.867 -177.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -91.78 -34.01 14.76 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.139 -0.482 . . . . 52.23 110.748 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.7 p -78.52 -18.4 54.8 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.045 -0.525 . . . . 74.24 112.074 -177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -98.56 129.2 45.1 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.38 0.609 . . . . 71.13 110.865 179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp . . . . . 0 C--N 1.322 -0.609 0 CA-C-N 115.535 -0.757 . . . . 72.42 110.981 -176.83 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.455 -0.186 0 N-CA-C 110.115 -0.328 . . . . 74.41 110.115 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 20.9 p-10 -88.08 -10.83 48.9 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.399 0.618 . . . . 72.55 110.378 179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 26.1 p-10 -112.44 159.61 18.57 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.362 -0.835 . . . . 73.25 110.458 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . 0.529 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . 42.3 tt0 -114.2 74.27 0.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.168 0.508 . . . . 54.1 110.545 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 68.55 19.95 8.53 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.095 -0.957 . . . . 71.12 109.54 173.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.514 ' HB3' ' CE2' ' B' ' 208' ' ' TYR . . . -151.53 167.04 29.29 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.291 -0.868 . . . . 74.43 111.325 -170.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.483 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -90.59 45.65 1.28 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.811 -0.631 . . . . 71.34 111.066 -179.154 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.529 ' CE2' ' HB3' ' B' ' 204' ' ' GLU . 69.3 m-85 -49.07 -49.54 41.05 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.357 -0.383 . . . . 62.35 111.476 -178.421 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.44 -34.8 69.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.142 -0.481 . . . . 70.52 111.819 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . . . . . . . . . 10.5 mmp_? -68.69 -59.27 3.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.462 -0.335 . . . . 62.25 110.223 -179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.77 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -61.92 -17.66 57.57 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.888 -0.597 . . . . 72.33 111.593 -176.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 24.3 m -60.43 -34.4 73.93 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 115.633 -0.712 . . . . 70.21 110.921 178.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.537 ' HB2' HD11 ' A' ' 17' ' ' LEU . 32.2 mt-10 -81.1 -25.42 36.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 61.14 110.18 -176.634 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.77 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.7 mm? -66.52 -41.22 89.15 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.641 -0.708 . . . . 74.53 110.209 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . . . . . . . . . 93.2 mt -73.99 -18.58 17.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 115.898 -0.592 . . . . 64.51 111.194 -179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.506 ' HG2' ' O ' ' B' ' 212' ' ' THR . 31.2 mmmt -62.47 -40.53 96.95 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 122.042 -0.411 . . . . 71.1 111.043 -178.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.2 tm? -65.79 -34.78 78.96 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.391 -0.596 . . . . 71.52 109.391 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.14 93.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.885 -0.598 . . . . 74.42 110.36 -178.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.563 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 24.4 m-80 -60.84 -35.07 75.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.961 -0.563 . . . . 73.43 110.678 178.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -72.08 -28.69 63.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 75.22 111.663 -179.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -84.22 -22.66 30.77 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.403 0.621 . . . . 53.24 110.032 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . 0.478 ' HA ' HG21 ' B' ' 232' ' ' VAL . 3.3 t-20 -75.84 -8.56 57.17 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.271 -0.877 . . . . 73.21 109.94 178.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.563 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 10.9 mm-40 -83.32 1.23 42.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.793 -0.64 . . . . 55.51 110.653 177.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.451 HD22 HG13 ' B' ' 227' ' ' ILE . 1.0 OUTLIER -89.33 111.62 22.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.356 -0.383 . . . . 73.12 110.157 -178.306 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.0 t -65.59 -36.69 84.5 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.986 0.736 . . . . 74.44 112.986 -173.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -78.69 -9.94 59.58 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.091 0.404 . . . . 54.41 112.091 -177.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.563 HG22 ' HB2' ' B' ' 231' ' ' GLU . 7.0 mt -101.15 145.06 12.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.541 -0.54 . . . . 43.31 109.541 178.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.75 ' HB2' ' HG2' ' B' ' 231' ' ' GLU . 38.0 mt-30 -78.55 150.45 32.83 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.958 -0.564 . . . . 75.33 109.726 -178.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -35.92 72.08 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.912 0.387 . . . . 40.45 110.519 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -71.71 -16.5 76.14 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.791 -0.641 . . . . 64.15 113.355 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.75 ' HG2' ' HB2' ' B' ' 228' ' ' GLN . 9.3 mm-40 -76.87 -31.33 56.73 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 117.477 0.639 . . . . 72.21 110.103 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . 0.478 HG21 ' HA ' ' B' ' 222' ' ' ASN . 22.0 t -72.05 -31.51 40.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.699 0.761 . . . . 62.44 109.762 178.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.14 -29.47 66.4 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.521 -0.763 . . . . 73.35 109.665 175.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.39 -33.41 37.13 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.592 -0.731 . . . . 65.22 111.424 -177.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 10.5 p -66.53 -36.74 83.42 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 110.096 -0.335 . . . . 71.2 110.096 178.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.57 ' CD1' HD12 ' A' ' 14' ' ' LEU . 3.2 t80 -65.78 -38.06 87.99 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.381 -0.6 . . . . 71.04 109.381 174.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.805 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 10.2 tpt -61.4 -54.38 44.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.232 -0.894 . . . . 72.43 110.639 178.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.613 ' CE3' ' HB3' ' A' ' 76' ' ' MET . 27.2 t-105 -64.01 -36.58 84.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.517 -0.765 . . . . 71.31 111.421 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . . . . . . . . . . . -62.01 -43.46 98.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.658 0.266 . . . . 72.11 110.744 179.052 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.01 -37.94 89.2 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 116.481 -0.327 . . . . 71.42 110.446 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.551 ' HB2' ' HB2' ' A' ' 73' ' ' TYR . . . -57.91 -39.99 79.3 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.475 -0.33 . . . . 51.03 111.347 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -75.02 -43.14 55.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.306 0.574 . . . . 74.42 110.283 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.425 ' HD2' HG23 ' A' ' 15' ' ' ILE . 14.5 t80 -69.81 -30.25 67.73 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.497 -0.774 . . . . 71.5 110.895 -175.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -79.87 -38.52 32.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.045 -0.525 . . . . 73.43 111.082 -175.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.14 -18.52 48.2 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.97 -0.559 . . . . 64.14 111.834 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -54.79 -34.22 62.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.789 -0.641 . . . . 63.42 111.227 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.844 ' HZ ' ' HA2' ' A' ' 30' ' ' GLY . 41.5 m-85 -67.5 -15.08 63.48 Favored 'General case' 0 CA--C 1.52 -0.173 0 N-CA-C 112.12 0.415 . . . . 75.35 112.12 -176.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . 0.639 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -55.99 -31.09 58.33 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.596 -0.812 . . . . 54.1 112.143 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 62.2 p -74.19 -14.23 60.91 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.722 0.296 . . . . 74.43 111.455 -177.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 34.0 p -98.21 -5.96 32.24 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.848 0.356 . . . . 63.21 111.119 -176.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 67.3 m -78.89 -41.97 28.38 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 116.137 -0.483 . . . . 73.41 111.647 -175.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.627 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 3.0 m-85 -147.06 176.61 9.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.235 0.457 . . . . 71.03 112.235 -177.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -101.09 -46.6 5.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.36 -0.836 . . . . 75.55 111.611 -172.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . . . . . . . . . 40.9 p -100.63 151.19 21.91 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.52 -0.309 . . . . 65.13 110.287 -177.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -63.29 -36.29 83.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.126 -0.488 . . . . 74.51 111.075 -177.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -65.74 -29.36 69.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.027 -0.533 . . . . 73.04 111.075 -176.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.758 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 25.6 mt-30 -91.25 -45.04 8.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 70.34 110.159 177.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 16.8 ttt -60.5 -41.93 95.3 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.952 -0.567 . . . . 73.14 111.552 -177.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.595 ' HB2' HG21 ' A' ' 85' ' ' ILE . 34.6 tt0 -64.48 -40.09 95.03 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.83 0.348 . . . . 74.13 111.329 -178.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -70.54 -4.78 24.7 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.174 0.512 . . . . 52.01 110.954 -179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.758 ' HG2' ' O ' ' B' ' 257' ' ' GLN . 71.9 mmtt -108.35 4.85 24.93 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-N 116.059 -0.519 . . . . 71.22 110.61 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.594 ' HA ' ' HE3' ' B' ' 265' ' ' MET . 2.6 ptpp? -60.18 -49.46 77.54 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.399 -0.52 . . . . 72.32 110.225 -177.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.569 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 7.2 tp-100 -86.02 -1.32 57.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.555 0.693 . . . . 72.34 110.074 -179.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . 0.415 ' HB3' ' O ' ' B' ' 261' ' ' LYS . 4.1 tp10 -79.74 -43.44 22.59 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.821 -0.627 . . . . 74.22 109.324 173.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.639 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 3.8 ptt? -86.37 -31.62 21.4 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 120.941 0.4 . . . . 74.14 110.204 177.462 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.44 ' HB2' ' HA ' ' B' ' 263' ' ' GLN . 60.6 mtp -77.31 7.84 4.8 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.403 -0.362 . . . . 64.52 110.952 177.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -78.79 -42.6 27.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.095 0.474 . . . . 61.22 110.067 176.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . . . . . . . . . 23.9 p90 -107.65 -12.93 15.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.807 -0.633 . . . . 73.32 111.751 -172.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . . . . . . . . . 5.4 m-30 -51.88 -51.6 55.64 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.791 0.329 . . . . 74.31 111.199 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.869 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -57.87 -49.04 78.05 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.365 0.603 . . . . 72.22 110.228 177.316 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -87.27 42.02 1.01 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.207 -0.906 . . . . 61.33 110.647 -174.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . . . . . . . . . 34.9 mtp180 -104.61 -42.3 5.45 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.419 -0.355 . . . . 60.43 110.455 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.731 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -93.32 9.65 35.4 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 120.503 -0.479 . . . . 65.2 110.769 -175.531 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -63.93 -48.75 75.32 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.929 0.395 . . . . 60.44 110.426 -179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -67.66 -25.88 65.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.448 0.642 . . . . 75.03 110.737 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . 0.631 ' HB3' ' HE3' ' A' ' 38' ' ' TRP . 56.0 mmm -83.45 -28.12 29.01 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.265 -0.88 . . . . 74.02 109.792 -178.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.549 ' HA ' ' HB1' ' A' ' 41' ' ' ALA . 1.9 tt -72.62 -41.74 65.24 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.353 -0.84 . . . . 64.12 108.946 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -61.01 -31.43 71.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.504 -0.771 . . . . 73.31 110.123 176.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -71.94 -7.52 49.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.265 -0.88 . . . . 75.21 111.848 -178.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -114.35 -8.22 12.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.95 0.405 . . . . 74.43 110.96 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.511 ' C ' ' H ' ' B' ' 283' ' ' ASP . 39.9 mtt -87.85 -162.77 0.85 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.269 -0.423 . . . . 73.13 110.248 173.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' B' ' 286' ' ' GLU . 5.0 mm-40 65.43 -22.9 0.09 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.79 0.836 . . . . 74.25 112.75 -176.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . 0.511 ' H ' ' C ' ' B' ' 281' ' ' MET . 20.6 t70 -48.03 -63.48 1.06 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.322 0.649 . . . . 71.32 111.883 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -68.0 -32.15 72.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.029 0.442 . . . . 54.43 110.813 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.603 HG21 ' HB2' ' A' ' 59' ' ' GLN . 46.0 mt -65.25 -56.96 12.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.666 -0.697 . . . . 75.23 111.52 -173.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 13.4 pt-20 -65.72 -21.01 66.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.848 0.356 . . . . 74.2 110.906 -177.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . 0.403 ' O ' ' HB3' ' B' ' 290' ' ' HIS . 45.4 m-80 -102.1 9.18 40.47 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 74.33 112.272 -177.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -58.38 -52.94 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.53 -0.468 . . . . 72.13 110.325 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -68.54 -18.3 64.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.199 -0.455 . . . . 52.33 110.954 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . 0.403 ' HB3' ' O ' ' B' ' 287' ' ' ASN . 4.7 t60 -72.67 -56.48 5.24 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.865 -0.607 . . . . 64.32 109.877 173.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 64.4 m-85 -64.0 -43.13 96.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.925 0.393 . . . . 54.25 110.907 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.635 ' HA ' ' HG2' ' B' ' 295' ' ' GLN . 8.0 tpp180 -73.95 -0.64 16.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.216 0.532 . . . . 73.42 110.959 -178.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -96.33 -23.04 16.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.096 0.474 . . . . 51.4 110.449 174.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.6 p -90.85 -12.72 35.44 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.433 0.635 . . . . 75.11 110.221 176.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.635 ' HG2' ' HA ' ' B' ' 292' ' ' ARG . 19.2 pt20 -123.28 176.32 6.18 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.338 -0.986 . . . . 75.34 108.338 175.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt . . . . . 0 C--N 1.314 -0.946 0 CA-C-O 118.707 -0.663 . . . . 74.24 110.421 -178.51 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.476 0.866 0 CA-C-O 121.296 0.57 . . . . 73.31 110.696 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 53.6 t-20 -148.86 -53.07 0.17 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.455 -0.943 . . . . 61.1 108.455 174.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 6' ' ' ALA . 1.9 p-10 -123.42 120.6 33.45 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.786 -0.643 . . . . 62.42 109.29 174.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -63.8 -57.59 9.44 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.613 -0.721 . . . . 74.12 110.517 -178.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -136.96 -56.61 0.72 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.987 0.423 . . . . 74.42 109.998 175.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . . . -68.25 167.1 15.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.78 -0.646 . . . . 60.33 111.652 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.406 ' HB2' ' HB2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -79.1 49.56 0.96 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.219 -0.9 . . . . 72.34 111.845 -178.127 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.411 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 54.2 m-85 -53.31 -42.42 66.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.955 0.407 . . . . 73.4 110.972 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.4 -9.38 47.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.68 -0.691 . . . . 74.44 112.222 -177.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.509 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -98.54 -62.21 1.27 Allowed 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.745 -0.465 . . . . 74.21 109.745 178.598 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.721 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -55.24 -23.88 24.8 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.743 0.646 . . . . 73.44 112.743 -178.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.7 t -66.43 -24.92 66.53 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.738 0.304 . . . . 72.4 110.887 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.59 ' HB2' HD11 ' B' ' 217' ' ' LEU . 31.2 mt-10 -80.75 -31.17 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.481 0.658 . . . . 63.21 109.528 -177.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.721 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.2 mm? -67.16 -48.73 67.11 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.03 -0.986 . . . . 75.02 110.144 -178.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.451 HG23 ' HD2' ' B' ' 243' ' ' TYR . 77.0 mt -65.82 -29.11 45.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 74.4 110.53 178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.29 -25.88 65.37 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 115.98 -0.555 . . . . 71.43 110.681 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.564 HD12 HD13 ' B' ' 214' ' ' LEU . 2.4 tm? -75.42 -45.94 35.76 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.86 -0.792 . . . . 45.52 108.86 175.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.45 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -59.87 -37.54 79.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.519 0.676 . . . . 73.21 109.692 176.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' A' ' 23' ' ' GLN . 7.7 t-20 -56.58 -30.39 63.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.775 -1.102 . . . . 51.14 110.529 177.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -78.24 -35.07 48.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.503 -0.772 . . . . 73.34 110.992 -176.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -79.2 -23.33 43.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.196 -0.456 . . . . 72.22 110.999 -176.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.416 HD22 ' HA ' ' A' ' 22' ' ' ASN . 2.8 t-20 -86.89 7.51 26.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.238 0.542 . . . . 72.43 110.499 -179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 19' ' ' ASN . 87.0 mm-40 -79.3 8.24 6.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 72.42 111.184 177.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.745 ' HB3' HG13 ' A' ' 27' ' ' ILE . 3.3 t30 -101.94 111.9 24.33 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.426 -0.583 . . . . 73.13 109.426 178.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 8.6 t -56.03 -33.51 64.99 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.382 -0.826 . . . . 65.45 112.626 -175.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -95.68 13.79 25.23 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.438 0.533 . . . . 75.14 112.438 -173.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.745 HG13 ' HB3' ' A' ' 24' ' ' ASN . 5.7 mt -111.78 150.25 14.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 109.542 -0.54 . . . . 74.14 109.542 172.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.858 ' HB2' ' HG2' ' A' ' 31' ' ' GLU . 42.6 mt-30 -72.47 144.26 48.13 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.958 -0.564 . . . . 74.25 109.976 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.8 m -63.66 -26.32 68.61 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.228 -0.656 . . . . 61.12 109.228 175.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.47 ' HA2' ' OG ' ' A' ' 33' ' ' SER . . . -78.65 -8.03 87.87 Favored Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.195 -0.912 . . . . 63.1 113.122 -179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.858 ' HG2' ' HB2' ' A' ' 28' ' ' GLN . 12.6 mm-40 -78.64 -25.72 45.04 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.437 0.619 . . . . 72.53 109.859 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.45 HG11 ' O ' ' A' ' 18' ' ' ALA . 16.2 t -93.46 -31.49 4.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.353 -0.84 . . . . 70.44 110.762 -176.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.47 ' OG ' ' HA2' ' A' ' 30' ' ' GLY . 10.2 p -66.71 -37.15 84.12 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.245 0.545 . . . . 64.24 109.844 175.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.21 -32.9 65.05 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.474 -0.785 . . . . 73.44 111.446 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.51 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 20.1 p -70.54 -31.79 68.97 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-O 120.905 0.383 . . . . 53.41 110.187 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.591 ' CD1' HD12 ' B' ' 214' ' ' LEU . 9.9 t80 -68.81 -41.35 78.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.879 -0.6 . . . . 72.21 109.456 174.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.752 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 11.1 ttm -64.06 -47.42 80.22 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.549 -0.75 . . . . 75.32 111.158 177.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 18.7 t-105 -61.31 -37.43 83.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.067 0.46 . . . . 75.44 110.751 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.572 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -68.93 -34.13 74.87 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.277 -0.42 . . . . 63.4 111.199 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.608 HD21 ' SD ' ' B' ' 237' ' ' MET . 48.8 tp -68.9 -35.94 77.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.017 0.437 . . . . 74.4 110.222 179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.03 -42.87 99.89 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.869 -0.605 . . . . 53.22 110.72 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.409 ' NH2' HD12 ' B' ' 215' ' ' ILE . 47.7 mtm180 -71.94 -19.98 61.82 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 71.23 111.036 -179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -89.18 -42.13 11.84 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.307 -0.406 . . . . 63.01 110.462 -177.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -69.71 -23.54 63.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 71.11 111.568 -179.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.37 61.56 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.144 0.497 . . . . 73.24 111.477 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 86.0 t90 -68.63 -31.46 70.63 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.025 -0.534 . . . . 71.43 110.881 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.453 ' CZ ' ' HA2' ' B' ' 230' ' ' GLY . 91.1 m-85 -79.01 2.37 20.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.187 -0.461 . . . . 73.44 112.049 -173.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.445 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -59.03 -34.51 79.48 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.486 -0.864 . . . . 72.23 112.101 177.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.7 p -74.36 -14.83 60.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.765 0.317 . . . . 52.31 111.597 -177.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 43.0 p -88.5 -4.04 58.69 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.734 -0.386 . . . . 54.43 110.713 -178.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.0 t -84.82 -36.97 21.28 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 116.371 -0.377 . . . . 74.14 110.756 -176.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -151.5 178.2 9.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.98 0.419 . . . . 75.41 111.311 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.407 ' HG3' HG23 ' A' ' 54' ' ' THR . 8.5 pt-20 -99.43 -50.11 4.21 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.581 -0.736 . . . . 75.11 110.985 -176.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.407 HG23 ' HG3' ' A' ' 53' ' ' GLU . 63.0 p -92.25 150.52 20.83 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 116.156 -0.475 . . . . 74.13 110.323 -178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.426 ' HE2' ' HB2' ' A' ' 55' ' ' LYS . 11.2 ptmm? -68.09 -27.98 66.95 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.714 -0.394 . . . . 73.31 110.142 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.401 ' H ' ' CD ' ' A' ' 56' ' ' GLU . 1.7 mp0 -56.15 -54.84 40.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.027 -0.533 . . . . 73.32 110.465 177.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.561 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 18.4 mt-30 -77.38 -34.43 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.824 -0.625 . . . . 62.34 110.31 -177.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.421 ' HB3' ' HA ' ' A' ' 55' ' ' LYS . 20.4 ttt -63.68 -44.61 93.19 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.467 -0.788 . . . . 63.42 111.079 -178.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.507 ' O ' ' HD2' ' A' ' 62' ' ' LYS . 35.6 tt0 -68.47 -28.6 67.18 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.798 -0.637 . . . . 73.34 111.234 -176.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.6 -6.68 51.55 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.494 -0.321 . . . . 44.53 111.801 -177.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.561 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 11.3 mmmm -112.83 10.06 19.06 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.683 -0.488 . . . . 72.41 109.683 -176.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HD2' ' O ' ' A' ' 59' ' ' GLN . 9.6 ptmt -51.27 -41.16 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 115.379 -0.828 . . . . 65.13 111.421 -177.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 63' ' ' GLN . 11.1 tp60 -87.76 -30.39 20.31 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.512 0.196 . . . . 74.11 110.622 -175.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -63.08 -37.17 86.14 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 116.377 -0.374 . . . . 71.03 111.302 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.451 ' HA ' ' CE2' ' A' ' 68' ' ' TYR . 23.2 ptp -83.27 -31.36 26.98 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.77 -0.826 . . . . 73.15 108.77 178.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.529 ' HE1' ' N ' ' B' ' 278' ' ' ASP . 21.3 mtp -86.63 33.86 0.65 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.306 -0.861 . . . . 73.44 112.456 -176.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -129.13 -46.27 1.23 Allowed 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 120.165 -0.614 . . . . 74.43 109.949 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.451 ' CE2' ' HA ' ' A' ' 65' ' ' MET . 16.3 p90 -72.42 -17.07 61.83 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.742 -0.383 . . . . 71.23 110.028 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.724 ' HA ' ' HD3' ' A' ' 72' ' ' ARG . 6.2 m-30 -58.21 -50.5 73.33 Favored 'General case' 0 CA--C 1.517 -0.304 0 N-CA-C 109.766 -0.457 . . . . 74.53 109.766 174.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.65 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.36 -47.11 79.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.669 0.747 . . . . 71.33 109.467 174.444 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -80.0 31.42 0.26 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.58 -1.191 . . . . 73.13 111.437 -176.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.724 ' HD3' ' HA ' ' A' ' 69' ' ' TYR . 4.8 mtp180 -103.19 -29.75 11.11 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 121.662 -0.649 . . . . 72.32 111.452 -176.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.914 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -115.95 14.65 16.19 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.325 -0.55 . . . . 74.24 111.493 -177.746 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 42.6 tttp -63.34 -50.83 68.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.457 -0.572 . . . . 74.23 109.457 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -66.9 -30.79 71.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.841 -0.618 . . . . 73.42 111.272 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 60.4 mtt -69.46 -41.25 76.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.235 0.54 . . . . 72.33 109.571 178.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 1.6 tt -68.92 -31.78 70.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.99 -1.005 . . . . 74.41 109.095 -179.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.569 ' N ' ' HE1' ' B' ' 266' ' ' MET . 16.1 t70 -61.86 -34.4 75.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.112 -0.949 . . . . 73.23 110.912 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -78.05 -4.2 46.03 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.874 -0.603 . . . . 52.22 111.1 -178.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -103.23 -31.18 10.23 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.099 0.476 . . . . 74.4 109.85 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.584 ' HG3' ' SD ' ' B' ' 266' ' ' MET . 25.0 mmt -68.82 176.32 3.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.457 -0.792 . . . . 74.32 110.663 174.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.587 ' HA ' ' HB ' ' A' ' 85' ' ' ILE . 9.6 mm-40 65.29 -30.6 0.13 Allowed 'General case' 0 C--O 1.222 -0.392 0 C-N-CA 124.331 1.053 . . . . 73.42 113.19 -177.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 81' ' ' MET . 22.7 t70 -57.76 -64.02 1.04 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.9 0.381 . . . . 73.32 110.851 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -68.15 -14.66 63.15 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.895 0.379 . . . . 71.32 110.953 178.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.587 ' HB ' ' HA ' ' A' ' 82' ' ' GLU . 63.3 mt -81.49 -57.71 4.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 65.42 111.025 -179.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 8.5 pt-20 -58.48 -34.68 71.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.931 0.396 . . . . 72.23 110.428 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.427 ' N ' ' HG3' ' A' ' 86' ' ' GLU . 50.6 m-80 -88.11 -0.55 57.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.049 -0.523 . . . . 74.43 111.462 -177.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.472 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 83.9 t80 -61.34 -43.51 98.75 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 120.4 -0.52 . . . . 63.34 109.863 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.21 -31.66 71.43 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.931 -0.577 . . . . 64.22 110.238 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -69.98 -52.44 24.27 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.62 -0.718 . . . . 63.44 109.865 177.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -59.58 -47.36 85.87 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.209 0.528 . . . . 65.22 110.885 178.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -69.98 -11.06 60.6 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.534 -0.757 . . . . 74.15 110.559 -177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -91.76 -34.97 14.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.957 0.408 . . . . 62.23 110.461 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 33.1 p -72.95 -25.73 61.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.141 -0.481 . . . . 75.3 111.634 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -92.83 152.18 19.58 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 110.101 -0.333 . . . . 64.21 110.101 177.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 46.5 mtmt . . . . . 0 C--N 1.323 -0.571 0 CA-C-N 116.248 -0.433 . . . . 65.02 111.092 -176.622 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.452 -0.358 0 CA-C-O 121.07 0.462 . . . . 75.2 110.177 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -124.63 157.8 34.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.838 -0.619 . . . . 62.43 109.551 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.544 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 4.2 p-10 -70.35 149.68 47.09 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.13 0.491 . . . . 72.54 111.114 -176.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -81.39 -90.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.805 -0.634 . . . . 72.42 111.365 -175.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -102.53 -36.83 8.23 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.285 0.564 . . . . 54.45 109.846 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.544 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -97.82 150.75 20.93 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.473 -0.785 . . . . 74.41 110.74 176.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.51 ' CE1' ' HA ' ' A' ' 35' ' ' SER . 0.1 OUTLIER -75.85 54.77 0.84 Allowed 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.659 -1.155 . . . . 63.35 112.121 179.75 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -52.8 -43.39 65.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.414 -0.357 . . . . 74.21 111.094 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -68.03 -10.77 56.33 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.824 -0.625 . . . . 70.55 112.086 -175.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.561 ' HA ' ' HE ' ' B' ' 210' ' ' ARG . 1.1 mmp_? -96.13 -60.83 1.55 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.921 -0.4 . . . . 70.53 109.921 176.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.719 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -57.24 -20.6 28.4 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.807 0.669 . . . . 65.41 112.807 -176.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . . . . . . . . . 14.6 t -67.26 -24.54 65.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.794 0.33 . . . . 71.23 111.038 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.475 ' HB2' HD11 ' A' ' 17' ' ' LEU . 41.8 mt-10 -87.34 -24.04 24.41 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 121.13 0.491 . . . . 75.32 109.962 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.719 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.8 mm? -68.88 -49.1 61.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.538 -0.755 . . . . 63.42 110.334 -178.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.572 HG13 ' HB1' ' A' ' 39' ' ' ALA . 65.2 mt -68.86 -25.23 29.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.01 0.433 . . . . 74.41 110.385 177.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.514 ' HD3' HE22 ' B' ' 220' ' ' GLN . 0.9 OUTLIER -59.0 -36.07 74.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.048 -0.524 . . . . 53.44 110.439 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' ' 13' ' ' GLU . 2.3 tm? -65.89 -43.55 87.95 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.096 -0.705 . . . . 74.03 109.096 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -61.1 -25.09 66.72 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 74.44 110.678 178.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' B' ' 216' ' ' LYS . 12.6 m120 -62.09 -35.09 77.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.008 -0.542 . . . . 75.33 110.247 176.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . 0.514 HE22 ' HD3' ' B' ' 216' ' ' LYS . 2.6 mp0 -74.33 -24.96 59.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.195 -0.457 . . . . 65.4 111.216 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . 0.428 ' HB2' HG13 ' B' ' 232' ' ' VAL . 62.7 mt-30 -86.85 -27.43 23.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.994 0.426 . . . . 72.34 110.33 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -81.17 -1.88 46.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.859 -0.61 . . . . 71.52 110.744 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 85.8 mm-40 -69.96 -17.52 63.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.108 0.48 . . . . 74.22 110.388 176.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.699 HD22 ' HG2' ' B' ' 226' ' ' GLU . 0.9 OUTLIER -79.6 124.53 28.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.965 -0.561 . . . . 73.34 110.109 176.101 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 3.7 t -99.86 -17.32 17.69 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 116.09 -0.505 . . . . 71.41 110.232 179.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . 0.699 ' HG2' HD22 ' B' ' 224' ' ' ASN . 2.0 pm0 -80.64 -6.42 58.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 75.54 110.932 176.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.425 HG13 ' HB3' ' B' ' 224' ' ' ASN . 5.2 mt -111.96 153.08 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.467 -0.568 . . . . 74.03 109.467 176.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -72.19 142.21 49.05 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 110.064 -0.347 . . . . 45.54 110.064 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 4.1 m -62.22 -24.08 67.03 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.523 0.678 . . . . 75.43 109.981 177.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . 0.453 ' HA2' ' CZ ' ' A' ' 47' ' ' PHE . . . -64.32 -32.16 83.28 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 115.383 -0.826 . . . . 25.0 112.676 178.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -65.09 -32.54 74.3 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.889 0.376 . . . . 75.43 110.673 -177.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . 0.428 HG13 ' HB2' ' B' ' 221' ' ' GLN . 11.8 t -75.09 -29.27 21.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.072 -0.513 . . . . 74.14 110.657 -178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 72.3 p -74.63 -24.96 58.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.437 0.637 . . . . 63.3 109.493 175.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -80.81 -33.91 34.38 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.446 -0.797 . . . . 64.22 110.906 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . . . . . . . . . 5.3 p -67.61 -36.63 81.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 120.898 0.38 . . . . 65.14 110.071 177.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.589 ' HZ ' ' HB3' ' B' ' 214' ' ' LEU . 2.1 t80 -68.39 -36.01 78.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.346 0.593 . . . . 74.23 109.406 174.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.914 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 5.3 tpt -63.31 -56.41 16.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.251 -0.886 . . . . 62.25 110.527 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . . . . . . . . . 24.3 t-105 -60.53 -35.61 76.41 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.206 -0.906 . . . . 72.2 111.103 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.42 ' HB1' HG13 ' A' ' 15' ' ' ILE . . . -65.99 -43.22 88.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.418 -0.355 . . . . 74.3 111.338 -179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 56.8 tp -63.18 -34.81 78.45 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 120.733 0.301 . . . . 70.41 110.489 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . . . . . . . . . . . -59.5 -48.9 79.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.991 -0.549 . . . . 73.22 111.102 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . 0.422 HH21 HD12 ' A' ' 15' ' ' ILE . 28.6 mtm180 -70.45 -27.81 64.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.246 -0.434 . . . . 75.04 111.125 -176.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.451 ' HD2' HG23 ' A' ' 15' ' ' ILE . 8.8 t80 -80.86 -34.86 33.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 72.3 110.349 -178.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -75.95 -35.82 59.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.029 -0.532 . . . . 71.1 110.852 -176.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -60.37 -22.69 63.59 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.967 -0.561 . . . . 73.34 111.798 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 86.5 t90 -55.19 -33.86 63.39 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.99 -0.55 . . . . 75.32 111.443 179.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -74.58 -7.46 53.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 75.34 111.975 -175.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -65.14 -34.59 90.08 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.271 -0.966 . . . . 74.31 111.491 176.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.2 m -71.22 -9.69 58.52 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.76 0.314 . . . . 70.34 111.681 -177.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 13.4 t -119.74 16.77 12.74 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.014 0.435 . . . . 74.53 110.388 178.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 17.6 t -90.22 -27.45 19.5 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.054 0.454 . . . . 72.0 109.941 178.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -146.06 170.41 16.71 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.222 -0.659 . . . . 73.42 109.222 174.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.553 ' HG3' HG23 ' B' ' 254' ' ' THR . 10.1 pt-20 -89.41 -37.38 14.87 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.787 -0.365 . . . . 64.53 111.557 -175.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.553 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.7 p -110.94 159.75 17.43 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 123.166 0.292 . . . . 63.01 110.535 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.614 ' HA ' ' HB3' ' B' ' 258' ' ' MET . 12.0 ptmm? -74.79 -26.14 59.54 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.847 -0.427 . . . . 72.44 109.847 178.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 16.7 mp0 -54.47 -42.7 70.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.667 -0.697 . . . . 72.43 110.619 175.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.571 ' O ' ' HG3' ' B' ' 261' ' ' LYS . 15.9 mt-30 -91.48 -37.12 13.35 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.763 -0.653 . . . . 70.45 110.394 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.614 ' HB3' ' HA ' ' B' ' 255' ' ' LYS . 17.9 ttt -60.56 -40.85 93.14 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.078 -0.51 . . . . 63.41 111.712 -179.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.472 ' HB2' HG21 ' A' ' 85' ' ' ILE . 31.5 tt0 -72.33 -31.17 65.42 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.067 -0.515 . . . . 73.31 111.844 -174.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -79.31 -13.42 59.66 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.266 0.555 . . . . 61.02 110.984 -167.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.577 ' C ' ' HD3' ' B' ' 261' ' ' LYS . 0.0 OUTLIER -126.78 26.37 6.22 Favored 'General case' 0 N--CA 1.423 -1.79 0 CA-C-N 115.67 -0.695 . . . . 74.53 112.138 -175.512 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.651 ' HA ' ' CE ' ' B' ' 265' ' ' MET . 0.0 OUTLIER -59.17 -35.0 72.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.095 -0.502 . . . . 74.12 109.907 175.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.408 ' N ' ' HG2' ' B' ' 262' ' ' LYS . 12.7 tp60 -73.09 -25.56 60.93 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.329 -0.396 . . . . 74.43 111.434 -176.31 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . 0.45 ' OE1' ' HB2' ' B' ' 261' ' ' LYS . 40.5 mt-10 -57.47 -55.16 38.37 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.219 0.533 . . . . 73.23 110.309 176.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.705 ' HA ' ' CE2' ' B' ' 268' ' ' TYR . 2.2 ptt? -72.33 -34.79 68.32 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.955 -0.566 . . . . 74.22 109.909 -177.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.584 ' SD ' ' HG3' ' A' ' 81' ' ' MET . 26.5 mtp -79.98 19.36 0.71 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.923 -0.581 . . . . 74.52 111.639 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -114.98 -44.06 3.06 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.574 -0.528 . . . . 73.33 109.574 175.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.705 ' CE2' ' HA ' ' B' ' 265' ' ' MET . 20.7 p90 -91.27 -19.41 23.02 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 116.016 -0.538 . . . . 73.53 111.561 -178.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.427 ' CE2' ' HB2' ' B' ' 265' ' ' MET . 1.6 m-30 -52.76 -48.17 66.96 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.825 0.345 . . . . 70.41 110.763 178.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.65 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -54.05 -47.97 71.06 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.598 -0.728 . . . . 53.33 111.217 178.353 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -91.66 26.88 2.19 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.376 -0.829 . . . . 72.21 111.765 -168.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 12.0 mtp180 -95.66 -26.86 15.56 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.485 -0.486 . . . . 64.32 111.626 -178.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.752 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.1 OUTLIER -103.06 11.1 37.64 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 120.523 -0.471 . . . . 71.21 110.45 -178.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.431 ' HE3' ' SD ' ' A' ' 70' ' ' MET . 18.6 ttmt -65.01 -43.35 92.79 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.119 -0.491 . . . . 71.21 110.403 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.43 -39.47 93.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.651 0.263 . . . . 45.35 111.418 176.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.5 mtt -61.31 -46.24 91.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.453 0.644 . . . . 70.31 109.727 177.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.444 ' CD2' ' HE2' ' B' ' 281' ' ' MET . 1.1 tt -67.58 -33.25 74.65 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.784 -1.098 . . . . 61.44 109.663 -178.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . 0.529 ' N ' ' HE1' ' A' ' 66' ' ' MET . 19.6 t70 -64.86 -28.38 69.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.253 -0.885 . . . . 74.43 110.425 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -90.33 -2.39 57.99 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.261 -0.881 . . . . 62.14 111.092 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -104.91 -23.76 12.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.986 0.422 . . . . 72.11 110.507 -179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.444 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.3 mmt -69.31 179.18 2.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.537 0.684 . . . . 71.21 111.672 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.722 ' HA ' HD12 ' B' ' 285' ' ' ILE . 30.2 mt-10 68.63 -12.29 0.37 Allowed 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 114.326 -1.306 . . . . 64.41 112.97 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.96 -58.93 5.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.991 0.424 . . . . 72.21 110.395 177.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 85.6 m-85 -72.65 -16.06 61.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.165 -0.471 . . . . 75.22 110.885 178.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.722 HD12 ' HA ' ' B' ' 282' ' ' GLU . 60.9 mt -77.54 -57.08 6.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.116 -0.493 . . . . 73.13 110.551 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.2 pt-20 -67.34 -25.26 65.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 52.24 110.809 -178.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -94.99 15.75 17.99 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.179 -0.464 . . . . 74.2 111.519 -178.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.499 ' O ' ' HB2' ' B' ' 292' ' ' ARG . 20.2 t80 -58.12 -50.09 74.71 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.198 -0.667 . . . . 75.13 109.198 173.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -57.95 -28.24 64.13 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.667 -0.697 . . . . 71.42 111.33 175.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -74.88 -55.62 5.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.065 -0.516 . . . . 73.43 110.323 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -69.5 -38.93 77.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.246 -0.434 . . . . 64.31 111.349 -177.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' B' ' 288' ' ' PHE . 0.6 OUTLIER -65.65 -20.0 66.13 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.087 0.47 . . . . 74.32 109.895 -179.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -85.53 -27.5 25.54 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.044 -0.525 . . . . 71.53 110.904 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 41.3 p -82.99 -8.71 59.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 73.44 111.186 -179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -116.51 160.1 21.11 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.207 -0.451 . . . . 71.31 110.356 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.293 -0.861 . . . . 62.03 109.626 -179.052 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 110.255 -0.276 . . . . 72.02 110.255 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -99.92 -86.47 0.38 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.616 0.245 . . . . 61.4 110.788 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.753 ' ND2' ' HA ' ' A' ' 7' ' ' PHE . 89.1 m-20 -127.52 170.3 12.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.116 0.484 . . . . 75.44 111.208 -176.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -97.31 -80.58 0.44 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.4 -0.963 . . . . 71.14 108.4 168.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -113.6 -47.63 2.98 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.897 -0.779 . . . . 72.45 108.897 170.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.517 ' O ' ' HB3' ' A' ' 3' ' ' ASN . . . -82.82 159.49 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.408 -0.815 . . . . 64.32 111.835 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.753 ' HA ' ' ND2' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -75.82 56.36 0.94 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.87 -1.059 . . . . 65.1 112.309 179.272 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.451 ' HE1' ' HZ2' ' B' ' 238' ' ' TRP . 58.5 m-85 -56.2 -44.35 79.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.514 -0.312 . . . . 73.42 111.419 -179.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -18.61 61.21 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.339 -0.391 . . . . 70.33 111.627 -177.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -88.18 -65.23 1.04 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.397 -0.365 . . . . 72.12 110.099 177.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.693 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -58.64 -21.94 55.28 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 112.68 0.622 . . . . 72.01 112.68 -175.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.642 HG23 ' HG2' ' A' ' 13' ' ' GLU . 6.1 t -59.41 -28.91 67.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.136 0.494 . . . . 71.21 110.814 179.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.642 ' HG2' HG23 ' A' ' 12' ' ' THR . 5.4 mm-40 -92.31 -26.3 18.17 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.874 -0.603 . . . . 71.43 110.171 -173.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.693 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.7 mm? -64.51 -45.03 89.04 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.298 -0.864 . . . . 62.53 109.178 173.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.519 HG13 ' HB1' ' B' ' 239' ' ' ALA . 89.4 mt -69.24 -34.76 64.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.689 -0.687 . . . . 73.11 110.373 175.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 tmmt? -64.22 -30.83 71.87 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.849 -0.614 . . . . 64.02 111.351 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.59 HD12 HD13 ' B' ' 214' ' ' LEU . 3.1 tm? -65.04 -41.85 94.85 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 108.946 -0.761 . . . . 70.31 108.946 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.94 70.57 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.378 -0.828 . . . . 74.54 110.865 -179.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -63.47 -26.36 68.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.817 -0.628 . . . . 64.21 110.978 178.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.417 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 2.7 mp0 -85.35 -8.61 58.37 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.207 -0.451 . . . . 75.43 111.194 179.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.428 ' OE1' HD21 ' B' ' 214' ' ' LEU . 80.8 mt-30 -104.68 -29.27 10.71 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.82 0.343 . . . . 74.15 110.498 177.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.423 ' ND2' ' HA ' ' A' ' 29' ' ' THR . 2.5 t-20 -83.08 -12.47 57.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.037 0.446 . . . . 73.44 110.569 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.417 ' OE1' ' HA ' ' A' ' 20' ' ' GLN . 14.9 pt20 -73.45 -1.01 16.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.175 0.512 . . . . 70.5 110.326 175.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.607 ' HB3' HG13 ' A' ' 27' ' ' ILE . 2.0 t30 -82.43 108.02 15.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 108.832 -0.803 . . . . 52.24 108.832 175.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 4.4 t -62.03 -25.61 67.76 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 113.028 0.751 . . . . 62.12 113.028 -171.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.436 ' HG2' HD22 ' A' ' 24' ' ' ASN . 1.5 pm0 -88.3 0.88 55.64 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.986 0.365 . . . . 72.42 111.986 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.607 HG13 ' HB3' ' A' ' 24' ' ' ASN . 4.1 mt -113.31 147.78 16.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.476 -0.564 . . . . 71.4 109.476 176.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -88.5 157.95 18.48 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.837 -0.431 . . . . 71.13 109.837 178.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.423 ' HA ' ' ND2' ' A' ' 22' ' ' ASN . 31.4 m -65.73 -27.54 68.39 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.107 0.48 . . . . 54.42 110.012 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -64.19 -29.94 76.4 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-N 115.63 -0.714 . . . . 73.51 112.669 178.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -69.96 -30.98 68.47 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 121.468 0.651 . . . . 72.11 109.612 -177.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 16.7 t -82.1 -32.89 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.189 -0.914 . . . . 54.42 110.771 -177.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.402 ' HB3' ' CE1' ' B' ' 247' ' ' PHE . 93.2 p -65.92 -28.77 69.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.315 0.579 . . . . 65.11 109.803 176.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -83.0 -32.44 26.95 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.608 -0.724 . . . . 65.41 111.216 -178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.437 ' HA ' ' CE1' ' B' ' 207' ' ' PHE . 15.1 p -70.51 -36.79 73.96 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.971 0.415 . . . . 71.55 109.968 -178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.709 ' HD1' HD12 ' B' ' 214' ' ' LEU . 17.2 t80 -64.93 -35.29 80.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.402 0.62 . . . . 74.31 109.713 175.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.61 ' CG ' ' HB3' ' B' ' 273' ' ' TYR . 13.2 ttm -73.27 -47.44 42.96 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.657 -0.701 . . . . 74.32 111.529 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . . . . . . . . . 14.9 t-105 -60.03 -36.63 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.919 0.39 . . . . 74.31 110.352 176.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.49 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -65.64 -38.09 88.4 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.217 -0.447 . . . . 73.51 110.862 177.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 41.0 tp -66.35 -38.48 87.71 Favored 'General case' 0 C--O 1.223 -0.294 0 N-CA-C 110.012 -0.366 . . . . 51.02 110.012 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.473 ' HB2' ' HB2' ' B' ' 273' ' ' TYR . . . -60.74 -28.23 68.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.34 -0.391 . . . . 74.44 111.155 179.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -86.12 -45.44 11.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.037 0.446 . . . . 73.33 110.665 178.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.46 ' HD2' HG23 ' B' ' 215' ' ' ILE . 24.5 t80 -70.22 -37.16 74.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.898 -0.592 . . . . 65.4 111.205 -175.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -76.7 -18.6 58.42 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.289 -0.414 . . . . 74.32 111.184 -174.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.565 ' HB2' HD23 ' B' ' 277' ' ' LEU . . . -78.68 -5.15 52.3 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.109 0.48 . . . . 71.42 110.968 178.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -57.41 -39.51 76.3 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.634 -0.712 . . . . 75.42 109.913 175.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.424 ' HA ' HG22 ' A' ' 50' ' ' THR . 92.8 m-85 -75.91 -9.08 58.31 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.903 -0.59 . . . . 62.15 111.38 -176.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.504 ' HA2' ' SD ' ' A' ' 65' ' ' MET . . . -67.13 -38.32 92.14 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 110.624 -0.99 . . . . 55.31 110.624 172.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.7 m -71.74 -6.81 44.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.494 0.318 . . . . 74.31 111.581 -178.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.424 HG22 ' HA ' ' A' ' 47' ' ' PHE . 6.1 t -117.44 10.98 13.75 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.209 0.528 . . . . 74.32 110.113 178.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.4 t -82.73 -44.24 15.86 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.954 -0.566 . . . . 53.31 110.236 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.562 ' CD2' ' HG3' ' A' ' 61' ' ' LYS . 1.1 m-85 -145.29 176.35 9.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.426 -0.352 . . . . 61.4 111.081 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.4 ' HG2' ' H ' ' A' ' 53' ' ' GLU . 7.9 pt-20 -97.77 -42.29 7.67 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.712 -0.676 . . . . 62.22 111.636 -173.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 63.8 p -102.57 152.41 21.19 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 116.746 -0.207 . . . . 65.34 110.509 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -65.85 -32.19 73.57 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.083 0.468 . . . . 71.44 110.17 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -52.62 -51.32 60.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.043 -0.981 . . . . 63.02 110.606 178.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.628 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 20.9 mt-30 -87.65 -32.92 19.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.525 -0.761 . . . . 61.15 111.064 -176.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 18.5 ttt -64.21 -42.43 96.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.894 0.378 . . . . 64.34 110.786 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.55 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 36.7 tt0 -65.67 -27.7 68.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.128 -0.487 . . . . 75.21 110.679 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.99 -8.45 57.42 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.358 -0.383 . . . . 71.11 110.778 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.628 ' HG2' ' O ' ' A' ' 57' ' ' GLN . 29.4 mmmt -114.87 -6.62 12.62 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 116.35 -0.386 . . . . 71.21 111.319 -176.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.703 ' HA ' ' HE3' ' A' ' 65' ' ' MET . 56.5 pttt -65.23 -44.7 87.36 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.614 -0.435 . . . . 65.12 110.956 -172.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.42 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 9.1 tp60 -74.96 -16.99 60.62 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.921 -0.4 . . . . 73.14 109.921 179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -78.82 -38.59 37.76 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.375 -0.375 . . . . 72.13 110.765 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.703 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 18.4 ptp -80.65 -27.92 37.02 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.633 -0.877 . . . . 71.35 108.633 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.423 ' CE ' ' HB3' ' B' ' 277' ' ' LEU . 45.5 mtp -90.45 9.6 28.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.994 -1.003 . . . . 64.3 111.248 179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -81.36 -37.15 28.72 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 109.401 -0.592 . . . . 74.12 109.401 179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.527 ' O ' ' HG3' ' A' ' 72' ' ' ARG . 48.3 p90 -106.83 -10.1 16.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.607 -0.724 . . . . 63.34 111.327 -175.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.431 ' HD1' ' HA ' ' A' ' 69' ' ' TYR . 2.3 m-30 -55.55 -51.35 67.36 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.714 0.292 . . . . 74.33 110.992 -178.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.886 ' HB3' ' HB3' ' B' ' 270' ' ' MET . 0.0 OUTLIER -56.83 -41.27 77.58 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.704 0.764 . . . . 74.33 110.008 175.854 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -80.71 3.74 21.17 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.417 -1.265 . . . . 73.24 112.443 -169.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.692 ' HB2' ' SD ' ' B' ' 237' ' ' MET . 48.0 mtm180 -82.76 -41.53 19.09 Favored 'General case' 0 CA--C 1.515 -0.372 0 O-C-N 121.653 -0.654 . . . . 73.33 110.621 -173.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.832 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -94.12 9.83 36.21 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.285 0.564 . . . . 64.11 109.924 -176.08 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -63.82 -50.36 69.21 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 115.222 -0.899 . . . . 64.01 110.003 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -68.93 -30.26 68.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.966 -0.561 . . . . 75.5 110.844 -179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.411 ' SD ' ' HE3' ' B' ' 238' ' ' TRP . 57.1 mtt -68.26 -38.54 81.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.378 0.609 . . . . 75.5 110.064 176.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.598 ' HB3' ' HE3' ' B' ' 266' ' ' MET . 0.5 OUTLIER -72.14 -44.85 62.49 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.125 -0.943 . . . . 73.51 110.63 -176.531 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.63 -41.21 80.92 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.314 0.578 . . . . 61.22 110.213 -178.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.87 -20.12 65.86 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.078 -0.965 . . . . 71.3 111.753 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.682 ' OD1' ' HD2' ' B' ' 242' ' ' ARG . 0.8 OUTLIER -92.83 -30.35 15.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.781 0.324 . . . . 72.34 110.868 179.721 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.593 ' HE2' ' HA ' ' B' ' 245' ' ' ALA . 21.6 mmt -61.89 -61.96 2.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.776 -0.647 . . . . 74.34 111.226 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.58 ' HA ' HD12 ' A' ' 85' ' ' ILE . 7.4 pt-20 -70.22 -13.08 62.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.721 -0.672 . . . . 72.43 112.771 -171.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -61.1 -51.96 66.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.884 0.374 . . . . 64.32 110.303 176.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -64.95 -36.51 84.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.128 0.49 . . . . 73.33 110.0 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.888 HD13 ' HA ' ' B' ' 259' ' ' GLN . 79.3 mt -63.69 -57.16 12.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.382 -0.826 . . . . 72.52 112.136 -176.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 11.8 pt-20 -61.72 -32.48 72.71 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 121.037 -0.265 . . . . 63.45 111.084 -176.036 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -93.2 5.24 52.22 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.342 -0.39 . . . . 65.15 111.592 -177.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.541 ' HB3' ' HB3' ' B' ' 255' ' ' LYS . 63.7 t80 -57.36 -49.88 74.74 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 121.481 -0.088 . . . . 72.0 111.225 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.445 ' OD2' ' HD3' ' B' ' 255' ' ' LYS . 72.1 m-20 -58.47 -31.41 67.8 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.985 0.421 . . . . 73.21 110.45 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -71.11 -55.61 7.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.917 -0.583 . . . . 74.44 110.435 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.487 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 30.9 m-85 -63.37 -42.39 98.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.893 0.377 . . . . 75.25 111.202 -179.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.477 ' O ' ' HD2' ' A' ' 92' ' ' ARG . 7.5 tmm_? -67.71 -19.58 65.17 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.037 -0.528 . . . . 75.51 110.227 -177.698 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -82.21 -34.15 29.06 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.431 -0.35 . . . . 72.21 110.819 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 5.0 p -75.77 -18.81 59.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.032 0.444 . . . . 72.43 110.628 177.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.487 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 26.5 mt-30 -77.65 127.42 32.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.815 -0.63 . . . . 75.42 109.4 173.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt . . . . . 0 C--N 1.318 -0.769 0 CA-C-N 116.236 -0.438 . . . . 70.41 110.732 -175.209 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 21.3 m . . . . . 0 CA--C 1.531 0.216 0 CA-C-O 120.809 0.338 . . . . 73.21 111.041 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -135.64 -79.74 0.42 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.414 -0.357 . . . . 63.23 110.335 178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.769 ' ND2' ' HA ' ' B' ' 207' ' ' PHE . 94.7 m-20 -134.19 179.17 6.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.124 -0.489 . . . . 75.12 110.281 -179.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . 0.447 ' HB3' ' HE2' ' B' ' 208' ' ' TYR . 13.6 tp10 -132.43 -77.37 0.5 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.092 -0.504 . . . . 75.34 110.239 177.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -98.92 -21.74 16.13 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.402 0.62 . . . . 74.55 109.769 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.469 ' O ' ' HB3' ' B' ' 203' ' ' ASN . . . -148.72 168.66 22.29 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.565 -0.743 . . . . 74.54 112.043 -174.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.769 ' HA ' ' ND2' ' B' ' 203' ' ' ASN . 0.1 OUTLIER -70.87 53.81 0.16 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.488 -1.233 . . . . 73.24 112.429 178.295 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.447 ' HE2' ' HB3' ' B' ' 204' ' ' GLU . 29.3 m-85 -56.24 -47.4 78.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.611 -0.268 . . . . 72.43 111.136 -178.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.94 -16.05 63.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.246 -0.434 . . . . 63.0 111.735 -176.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.681 ' HA ' ' HE ' ' B' ' 210' ' ' ARG . 0.3 OUTLIER -88.12 -63.59 1.28 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.44 -0.345 . . . . 53.12 110.16 177.673 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.624 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -53.67 -29.65 39.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 112.905 0.705 . . . . 72.12 112.905 -176.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' B' ' 216' ' ' LYS . 7.1 t -64.68 -25.01 67.76 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.675 0.274 . . . . 45.1 111.073 -177.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -82.3 -24.3 34.73 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 121.251 0.548 . . . . 73.21 109.622 -178.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.709 HD12 ' HD1' ' A' ' 36' ' ' PHE . 3.5 mm? -68.9 -42.63 76.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.347 -0.842 . . . . 70.51 109.279 177.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.49 HG13 ' HB1' ' A' ' 39' ' ' ALA . 87.8 mt -68.91 -28.48 39.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.423 -0.808 . . . . 72.12 110.255 177.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' B' ' 212' ' ' THR . 28.4 mmmt -57.27 -47.26 81.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.349 -0.387 . . . . 64.23 111.503 178.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.509 HD13 ' O ' ' B' ' 217' ' ' LEU . 1.9 tm? -61.59 -32.17 72.26 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.5 -0.556 . . . . 74.12 109.5 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -68.8 -32.98 73.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.819 -0.628 . . . . 54.54 110.821 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -66.56 -31.05 71.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.877 0.37 . . . . 71.22 110.783 178.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -79.66 -4.81 53.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.08 -0.509 . . . . 64.11 111.175 -178.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -110.17 -17.86 13.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.529 0.68 . . . . 72.44 109.295 172.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -78.96 -21.54 47.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.871 -1.058 . . . . 75.42 110.196 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -74.17 12.37 0.74 Allowed 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 115.671 -0.695 . . . . 73.34 111.975 179.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.501 ' HB3' HG13 ' B' ' 227' ' ' ILE . 1.0 OUTLIER -98.31 109.35 22.12 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 44.32 109.72 179.599 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . 0.4 ' H ' HG22 ' B' ' 225' ' ' THR . 2.7 t -65.46 -28.89 69.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.488 0.551 . . . . 61.44 112.488 -173.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . 0.425 ' HG2' HD22 ' B' ' 224' ' ' ASN . 1.7 pm0 -87.91 4.58 44.23 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.915 0.339 . . . . 61.2 111.915 -179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.501 HG13 ' HB3' ' B' ' 224' ' ' ASN . 4.1 mt -117.86 161.66 16.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.149 -0.686 . . . . 52.22 109.149 174.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.744 HE21 ' N ' ' B' ' 228' ' ' GLN . 0.0 OUTLIER -105.29 152.23 23.16 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.477 -0.564 . . . . 74.53 109.477 178.554 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 5.0 m -55.83 -28.28 55.59 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.03 0.443 . . . . 72.15 110.687 179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -64.11 -22.67 67.18 Favored Glycine 0 C--N 1.334 0.434 0 CA-C-N 115.705 -0.679 . . . . 75.43 113.22 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -83.84 -17.13 41.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.232 0.539 . . . . 50.31 110.018 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 15.2 t -90.2 -39.52 12.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 72.42 109.854 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 33.5 p -65.8 -34.36 77.98 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.21 0.529 . . . . 63.34 109.841 175.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -72.03 -34.33 68.72 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.571 -0.741 . . . . 33.24 111.325 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.467 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 4.0 p -75.82 -32.64 59.92 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.986 -0.376 . . . . 34.33 109.986 -179.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.47 ' CD1' HD12 ' A' ' 14' ' ' LEU . 2.9 t80 -64.96 -39.73 93.94 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.001 -0.74 . . . . 74.24 109.001 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.832 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 1.2 ttm -66.65 -48.3 69.83 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.395 -0.82 . . . . 62.14 111.226 177.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.451 ' HZ2' ' HE1' ' A' ' 8' ' ' TYR . 19.2 t-105 -60.62 -44.46 96.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.395 -0.366 . . . . 72.02 110.758 177.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.533 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -61.95 -36.26 80.88 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.412 . . . . 74.42 111.057 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . 42.8 tp -63.52 -40.56 97.37 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.378 -0.374 . . . . 71.1 110.278 177.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.584 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.77 -45.1 94.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.065 0.46 . . . . 72.45 110.344 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . 0.682 ' HD2' ' OD1' ' A' ' 80' ' ' ASN . 11.1 mmm180 -58.87 -41.28 86.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 63.31 110.755 178.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' B' ' 246' ' ' TRP . 10.5 t80 -75.92 -38.22 57.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.891 -0.595 . . . . 64.04 111.028 -175.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -69.55 -31.78 70.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.887 0.328 . . . . 64.41 111.887 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.593 ' HA ' ' HE2' ' A' ' 81' ' ' MET . . . -72.32 -17.64 61.84 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.223 0.535 . . . . 65.03 111.266 -179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . 0.404 ' HB3' ' O ' ' B' ' 243' ' ' TYR . 12.6 t90 -64.64 -23.69 67.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.614 -0.721 . . . . 74.2 109.68 175.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 0.429 ' O ' HG22 ' B' ' 250' ' ' THR . 69.1 m-85 -85.47 2.89 42.7 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.095 -0.502 . . . . 74.24 111.39 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . . . . . . . . . . . -64.75 -35.87 92.44 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.237 -0.982 . . . . 61.51 111.445 175.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . . . . . . . . . 15.0 m -62.33 -24.57 67.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.681 0.277 . . . . 71.54 111.658 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . 0.429 HG22 ' O ' ' B' ' 247' ' ' PHE . 14.6 t -98.27 10.7 40.05 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.606 -0.438 . . . . 44.14 110.738 -178.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 33.7 t -87.93 -54.58 4.16 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.966 -0.383 . . . . 61.22 109.966 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.643 ' CD2' ' HG3' ' B' ' 261' ' ' LYS . 2.0 m-85 -138.95 178.05 7.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.165 0.507 . . . . 72.54 111.736 178.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.54 ' HG3' HG23 ' B' ' 254' ' ' THR . 8.9 pt-20 -95.45 -47.22 6.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.12 -0.946 . . . . 71.31 111.628 -173.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.54 HG23 ' HG3' ' B' ' 253' ' ' GLU . 65.2 p -102.67 161.85 13.4 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.572 -0.285 . . . . 71.42 110.501 -178.329 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 88' ' ' PHE . 20.8 ptmt -72.38 -29.8 64.09 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.877 -0.329 . . . . 73.4 110.503 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -61.05 -41.7 97.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.938 -0.574 . . . . 50.33 110.574 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.616 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 23.3 mt-30 -86.81 -39.75 15.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.922 -0.581 . . . . 74.52 110.809 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . . . . . . . . . 13.3 ttt -63.81 -35.8 81.8 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.404 -0.362 . . . . 73.11 111.194 -178.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.888 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.9 tt0 -62.52 -40.85 98.08 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.934 0.397 . . . . 74.23 111.073 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -71.35 -9.12 57.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.836 -0.62 . . . . 64.14 111.183 -178.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.643 ' HG3' ' CD2' ' B' ' 252' ' ' PHE . 31.5 mmmt -107.99 -3.44 18.79 Favored 'General case' 0 CA--C 1.508 -0.638 0 N-CA-C 111.947 0.351 . . . . 53.21 111.947 -173.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' B' ' 263' ' ' GLN . 50.9 pttt -59.51 -49.73 76.65 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.217 -0.593 . . . . 74.32 110.401 -177.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . 0.504 ' N ' ' HG3' ' B' ' 262' ' ' LYS . 17.8 tp60 -67.46 -23.19 65.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.873 0.368 . . . . 60.32 110.568 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -82.45 -34.24 28.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.192 -0.458 . . . . 73.44 111.535 -178.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . . . . . . . . . 21.6 ptp -83.88 -25.34 30.31 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.883 -0.784 . . . . 71.42 108.883 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.598 ' HE3' ' HB3' ' A' ' 77' ' ' LEU . 56.1 mtp -85.83 -12.33 51.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.096 -0.956 . . . . 74.21 110.664 177.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -54.02 -41.35 67.92 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.099 -0.5 . . . . 53.21 111.087 -175.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.573 ' O ' ' HG3' ' B' ' 272' ' ' ARG . 17.9 p90 -105.89 -6.11 19.16 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.667 -0.697 . . . . 72.43 110.601 -175.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.486 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 1.4 m-30 -59.3 -54.06 51.13 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.641 -0.254 . . . . 75.4 110.477 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.886 ' HB3' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -50.98 -47.88 61.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.305 0.574 . . . . 65.01 110.207 174.492 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -86.05 23.68 1.46 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.113 -0.949 . . . . 71.15 112.272 -169.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.573 ' HG3' ' O ' ' B' ' 268' ' ' TYR . 36.2 mtm180 -95.24 -28.84 14.82 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 121.382 -0.824 . . . . 71.15 111.576 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.61 ' HB3' ' CG ' ' A' ' 37' ' ' MET . 0.1 OUTLIER -112.2 13.04 20.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.175 0.512 . . . . 65.13 110.195 -178.689 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . 0.479 ' HA ' ' CE ' ' A' ' 70' ' ' MET . 81.8 tttt -64.34 -51.98 60.66 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.648 -0.705 . . . . 72.53 110.843 -176.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.5 -30.75 68.68 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.926 0.393 . . . . 73.24 110.676 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.0 -39.77 93.39 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.759 -0.655 . . . . 54.11 110.13 177.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.565 HD23 ' HB2' ' A' ' 45' ' ' ALA . 0.5 OUTLIER -67.99 -40.03 83.15 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.481 -0.782 . . . . 64.21 110.57 -176.45 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -63.06 -34.87 78.51 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.025 0.44 . . . . 64.23 110.68 179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -67.59 -23.63 65.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 44.33 110.886 179.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 -91.42 -29.28 17.14 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 74.44 110.124 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.577 ' O ' HG13 ' B' ' 285' ' ' ILE . 23.9 mmt -61.54 -60.21 4.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.916 -0.584 . . . . 75.33 109.78 173.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.702 ' HA ' ' HB ' ' B' ' 285' ' ' ILE . 72.8 mm-40 -57.23 -22.6 42.26 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.595 -0.729 . . . . 71.51 111.926 -177.053 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -47.83 -50.37 26.33 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.436 0.46 . . . . 43.04 110.867 -179.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -100.15 -10.61 21.26 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.369 -0.378 . . . . 75.2 111.729 178.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.702 ' HB ' ' HA ' ' B' ' 282' ' ' GLU . 68.1 mt -74.25 -55.25 12.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.726 -0.39 . . . . 65.43 110.503 177.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.665 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 7.1 pt-20 -66.18 -34.74 78.72 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.678 -0.409 . . . . 70.01 110.524 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -90.11 8.37 33.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.357 -0.383 . . . . 21.43 111.361 -178.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -55.85 -56.14 24.11 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 110.064 -0.347 . . . . 75.41 110.064 178.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -74.58 6.07 4.18 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.213 -0.449 . . . . 73.33 111.527 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -95.08 -55.4 3.09 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.753 -0.832 . . . . 74.2 108.753 172.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -65.68 -41.83 91.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.248 0.547 . . . . 72.43 110.22 177.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . 0.459 ' O ' ' HD2' ' B' ' 292' ' ' ARG . 3.0 tmm_? -71.21 -13.9 62.07 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.55 -0.75 . . . . 74.14 110.23 -178.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -90.98 -25.51 19.69 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.28 -0.418 . . . . 35.42 110.819 177.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 23.2 p -83.36 -9.19 59.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.102 0.477 . . . . 64.41 110.517 177.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -100.72 157.55 16.61 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.871 -0.604 . . . . 72.31 109.489 176.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . 0.478 ' HE3' ' HB2' ' B' ' 296' ' ' LYS . 30.4 mtmt . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.227 -0.892 . . . . 74.13 109.843 -175.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 121.129 0.49 . . . . 73.43 110.3 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -96.06 1.23 52.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.795 -0.639 . . . . 74.32 110.356 -177.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -149.56 169.4 21.02 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.964 -0.562 . . . . 73.23 110.598 -178.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -90.54 -71.84 0.6 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.206 -0.665 . . . . 55.14 109.206 172.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -129.67 -46.64 1.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.73 -0.668 . . . . 62.04 110.049 176.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.89 164.45 22.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.937 -0.574 . . . . 42.25 111.599 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.543 ' CE1' ' HA ' ' B' ' 235' ' ' SER . 0.4 OUTLIER -80.36 43.17 0.62 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.572 -0.74 . . . . 73.33 112.009 -175.589 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -44.49 -58.81 2.76 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.103 0.409 . . . . 74.42 112.103 -173.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.6 -21.64 53.98 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.171 0.804 . . . . 40.11 113.171 -173.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -75.94 -49.22 18.38 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.338 -0.226 . . . . 72.22 111.032 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.69 ' HA ' HD23 ' A' ' 14' ' ' LEU . . . -71.01 -17.48 62.63 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.729 0.776 . . . . 73.44 109.933 -174.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 18.4 m -57.26 -37.41 72.31 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 114.453 -1.249 . . . . 64.23 111.292 176.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HB2' HD11 ' B' ' 217' ' ' LEU . 27.3 mt-10 -81.27 -21.13 39.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.202 0.525 . . . . 73.33 110.276 -176.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 11' ' ' ALA . 3.5 mm? -69.1 -41.99 76.73 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.563 -0.744 . . . . 73.35 109.402 178.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.491 HG13 ' HB1' ' B' ' 239' ' ' ALA . 79.0 mt -74.07 -23.48 18.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.963 -0.562 . . . . 60.34 110.238 175.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 21.2 mmmt -58.67 -41.3 85.85 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.239 -0.437 . . . . 70.43 111.335 178.249 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 17' ' ' LEU . 2.6 tm? -66.8 -31.38 71.97 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.266 -0.642 . . . . 45.12 109.266 179.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 -33.23 72.54 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.43 -0.805 . . . . 71.43 110.231 -177.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.657 ' O ' ' HG3' ' A' ' 23' ' ' GLN . 95.1 m-20 -61.39 -42.41 98.68 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.652 -0.704 . . . . 52.52 110.494 179.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.44 -27.38 67.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.947 -0.569 . . . . 75.14 111.461 -177.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -82.65 -30.13 29.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.276 0.56 . . . . 64.33 109.916 176.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.441 ' ND2' HG23 ' A' ' 29' ' ' THR . 29.2 t-20 -73.8 -20.07 60.58 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.501 -0.772 . . . . 51.31 110.356 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.657 ' HG3' ' O ' ' A' ' 19' ' ' ASN . 89.7 mt-30 -64.2 -16.48 62.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.103 -0.498 . . . . 70.41 111.059 179.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.464 HD22 HG13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -71.88 104.64 3.54 Favored 'General case' 0 CA--C 1.517 -0.292 0 N-CA-C 109.556 -0.535 . . . . 70.13 109.556 177.368 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 3.4 t -65.68 -34.53 78.43 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.46 -0.791 . . . . 60.02 111.912 -174.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -78.7 -5.78 54.03 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.325 0.491 . . . . 52.31 112.325 -176.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.464 HG13 HD22 ' A' ' 24' ' ' ASN . 7.2 mt -106.05 152.14 7.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.057 0.456 . . . . 63.24 110.222 179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -79.35 155.96 28.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.76 -0.655 . . . . 74.34 109.68 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.441 HG23 ' ND2' ' A' ' 22' ' ' ASN . 8.1 m -69.84 -23.97 63.38 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.116 0.484 . . . . 72.11 110.431 -177.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -71.44 -14.62 74.72 Favored Glycine 0 C--N 1.333 0.396 0 CA-C-N 115.762 -0.654 . . . . 73.32 113.587 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -71.75 -37.92 70.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.416 0.608 . . . . 74.5 110.482 177.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 20.4 t -73.32 -43.03 57.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.598 -0.728 . . . . 74.15 110.695 -176.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.3 p -62.09 -44.11 97.37 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.085 0.469 . . . . 74.43 110.841 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.2 -32.92 74.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.812 -0.631 . . . . 60.45 111.14 -179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 52.7 m -65.89 -38.96 90.12 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 109.878 -0.416 . . . . 71.52 109.878 177.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.717 ' HB3' HD13 ' B' ' 240' ' ' LEU . 1.2 t80 -67.12 -36.8 82.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.871 -0.604 . . . . 74.34 109.747 176.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.608 ' HG3' ' HB3' ' B' ' 273' ' ' TYR . 6.0 tpt -59.47 -53.76 54.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.157 -0.929 . . . . 54.55 110.473 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TRP . . . . . 0.469 ' NE1' ' HD2' ' A' ' 42' ' ' ARG . 18.1 t-105 -67.7 -38.7 84.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.943 -0.571 . . . . 75.44 111.42 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.47 ' HB1' HG13 ' B' ' 215' ' ' ILE . . . -62.4 -39.13 92.23 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.535 -0.302 . . . . 71.54 111.675 -176.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.474 HD13 ' HB3' ' B' ' 236' ' ' PHE . 47.0 tp -65.44 -31.29 72.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.849 0.357 . . . . 75.53 110.574 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -62.02 -46.18 90.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.248 -0.433 . . . . 74.45 110.918 -179.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.469 ' HD2' ' NE1' ' A' ' 38' ' ' TRP . 28.8 mtp180 -68.84 -34.0 74.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 65.34 110.317 -177.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.434 ' HD2' HG23 ' B' ' 215' ' ' ILE . 6.0 t80 -76.64 -32.84 58.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.81 -0.632 . . . . 73.53 110.896 -175.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 71.1 m-20 -79.21 -33.59 43.68 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.7 -0.227 . . . . 72.14 111.439 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.32 -17.93 64.97 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.189 0.518 . . . . 63.21 110.927 178.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 83.5 t90 -57.39 -32.32 66.7 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.193 -0.912 . . . . 74.32 111.062 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -85.05 1.68 46.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 61.13 111.969 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.59 -38.06 90.47 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.445 -0.883 . . . . 63.5 111.898 179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.0 p -70.23 -17.9 63.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.85 0.357 . . . . 74.35 111.528 -177.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 28.2 p -92.44 -7.18 48.29 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 65.43 110.772 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -75.63 -35.96 60.35 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.229 -0.441 . . . . 52.35 111.677 -173.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.754 ' HE2' ' HG2' ' A' ' 61' ' ' LYS . 1.0 OUTLIER -147.27 175.67 10.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.329 0.585 . . . . 73.11 112.349 -175.8 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.629 ' HG3' HG23 ' A' ' 54' ' ' THR . 16.3 pt-20 -89.24 -37.08 15.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.08 -0.964 . . . . 73.03 111.546 -174.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.629 HG23 ' HG3' ' A' ' 53' ' ' GLU . 65.4 p -118.78 157.69 27.05 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.132 -0.486 . . . . 75.32 110.526 -177.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.475 ' HB3' ' CB ' ' B' ' 288' ' ' PHE . 21.2 ptmt -66.53 -29.95 70.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.741 0.305 . . . . 73.54 110.503 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -60.34 -49.99 75.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.872 -0.604 . . . . 74.24 110.384 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.678 ' O ' ' HD3' ' A' ' 61' ' ' LYS . 21.8 mt-30 -78.08 -35.36 49.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.697 -0.683 . . . . 64.1 110.411 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 17.0 ttt -61.94 -41.29 97.79 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.049 0.452 . . . . 74.54 110.816 178.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.59 ' HA ' HD13 ' B' ' 285' ' ' ILE . 36.1 tt0 -65.47 -45.3 84.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.771 -0.65 . . . . 61.33 111.848 -176.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.36 -24.54 64.81 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.0 0.428 . . . . 64.33 111.355 -175.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.754 ' HG2' ' HE2' ' A' ' 52' ' ' PHE . 3.9 mptp? -93.47 8.47 40.5 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 116.033 -0.531 . . . . 75.03 111.347 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.565 ' HG3' ' N ' ' A' ' 63' ' ' GLN . 17.6 ptpt -51.7 -48.48 63.52 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 109.507 -0.553 . . . . 61.33 109.507 177.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.565 ' N ' ' HG3' ' A' ' 62' ' ' LYS . 12.8 tp60 -72.22 -26.03 61.87 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.103 -0.498 . . . . 72.21 110.712 -176.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -81.84 -32.8 31.01 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.022 -0.536 . . . . 54.24 111.495 -176.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.8 ptp -83.36 -26.4 30.53 Favored 'General case' 0 CA--C 1.52 -0.192 0 N-CA-C 109.051 -0.722 . . . . 44.14 109.051 178.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.596 ' HG2' HD22 ' B' ' 277' ' ' LEU . 79.4 mtp -83.86 -4.68 58.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.16 -0.927 . . . . 64.3 111.756 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -71.59 -29.28 64.53 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 108.781 -0.822 . . . . 73.11 108.781 -176.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 72' ' ' ARG . 28.6 m-85 -99.93 -5.99 27.38 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.653 -1.158 . . . . 75.4 111.441 179.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.508 ' CD2' ' HA ' ' A' ' 66' ' ' MET . 19.1 m-30 -77.3 -54.05 6.94 Favored 'General case' 0 N--CA 1.44 -0.939 0 N-CA-C 107.685 -1.228 . . . . 64.24 107.685 169.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.498 ' HE1' HD13 ' B' ' 277' ' ' LEU . 0.0 OUTLIER -60.08 -66.27 0.55 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.308 -0.406 . . . . 71.54 110.21 171.313 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' A' ' 72' ' ' ARG . 10.6 t70 -95.44 82.62 3.7 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.437 0.532 . . . . 72.42 112.437 -171.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 71' ' ' ASP . 8.8 mmm180 -153.15 -37.01 0.1 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.278 -0.419 . . . . 73.31 111.53 166.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.817 ' HB3' ' HG3' ' B' ' 237' ' ' MET . 0.1 OUTLIER -84.74 2.51 41.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 119.804 -0.758 . . . . 72.11 109.019 178.79 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.431 ' HA ' ' HE2' ' B' ' 270' ' ' MET . 85.1 tttt -60.65 -50.55 73.05 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.039 -0.982 . . . . 65.1 110.079 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -66.16 -37.19 85.05 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.255 -0.43 . . . . 75.05 111.113 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 61.5 mtt -63.01 -41.44 99.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.416 0.627 . . . . 74.4 109.919 177.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 73' ' ' TYR . 1.3 tt -67.16 -43.06 83.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.815 -1.084 . . . . 73.01 109.86 -179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.84 -41.17 86.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.279 -0.873 . . . . 65.13 110.672 178.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -73.67 -10.36 59.61 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.413 -0.812 . . . . 70.24 111.987 -176.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.46 -3.17 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.783 -0.367 . . . . 72.5 111.463 -179.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . 0.437 ' HE3' ' CD2' ' A' ' 77' ' ' LEU . 23.8 mtt -88.16 -177.77 5.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.287 0.565 . . . . 61.34 111.752 177.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.772 ' HG2' HD12 ' A' ' 85' ' ' ILE . 34.1 mt-10 66.77 -3.75 0.87 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.634 -1.166 . . . . 71.03 112.879 -177.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -56.45 -39.39 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.129 0.49 . . . . 71.31 110.405 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -92.71 -16.14 25.84 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.971 -0.559 . . . . 74.25 110.514 178.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.772 HD12 ' HG2' ' A' ' 82' ' ' GLU . 62.0 mt -79.1 -55.58 9.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.072 -0.513 . . . . 65.22 110.808 -175.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.609 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 7.0 pt-20 -64.64 -31.19 72.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.124 0.488 . . . . 55.54 110.268 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -89.12 7.72 33.66 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.827 -0.624 . . . . 52.55 111.382 -177.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.412 ' HB3' ' HD2' ' B' ' 255' ' ' LYS . 70.0 t80 -62.24 -40.81 97.39 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.072 -0.344 . . . . 75.54 110.072 178.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -57.26 -41.73 80.19 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.402 -0.592 . . . . 61.04 109.402 176.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -65.31 -54.33 30.73 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.142 -0.935 . . . . 72.01 110.748 177.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.568 ' O ' ' HG3' ' A' ' 95' ' ' GLN . 53.9 m-85 -61.24 -49.43 77.12 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.098 0.407 . . . . 73.03 112.098 -178.342 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 2.5 tpm_? -60.46 -19.85 57.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.25 0.548 . . . . 63.41 111.103 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -97.25 -29.36 13.6 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.171 -0.468 . . . . 74.03 111.156 -178.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 17.4 p -87.53 -4.9 58.97 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.09 -0.504 . . . . 74.52 111.071 179.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.568 ' HG3' ' O ' ' A' ' 91' ' ' TYR . 81.5 mt-30 -70.53 136.17 49.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.035 -0.53 . . . . 63.13 109.801 173.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 115.941 -0.572 . . . . 74.42 111.494 -170.378 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 201' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 C--O 1.234 0.269 0 CA-C-O 120.816 0.341 . . . . 61.21 110.628 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 202' ' ' ASN . . . . . . . . . . . . . 28.0 p-10 -95.96 13.81 25.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.535 0.683 . . . . 62.12 109.771 175.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 203' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' B' ' 206' ' ' ALA . 3.2 p-10 -133.88 143.42 48.28 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.068 -0.969 . . . . 74.34 108.57 174.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 204' ' ' GLU . . . . . 0.563 ' H ' ' HD2' ' B' ' 208' ' ' TYR . 38.4 tt0 -85.51 -83.48 0.17 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.848 0.356 . . . . 73.32 111.092 -178.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 205' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -116.18 0.11 12.82 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.401 0.62 . . . . 73.42 110.739 -177.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 206' ' ' ALA . . . . . 0.561 ' O ' ' HB2' ' B' ' 203' ' ' ASN . . . -143.29 179.9 6.8 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.175 -0.466 . . . . 70.12 111.629 -174.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 207' ' ' PHE . . . . . 0.429 ' HB2' ' HB2' ' B' ' 210' ' ' ARG . 0.2 OUTLIER -73.51 43.91 0.15 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.218 -0.901 . . . . 71.23 112.139 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 208' ' ' TYR . . . . . 0.563 ' HD2' ' H ' ' B' ' 204' ' ' GLU . 59.0 m-85 -60.52 -26.04 66.56 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.08 0.466 . . . . 75.03 110.991 -178.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -74.48 -24.04 58.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.755 -0.657 . . . . 72.33 111.539 178.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 210' ' ' ARG . . . . . 0.429 ' HB2' ' HB2' ' B' ' 207' ' ' PHE . 25.1 mmt180 -89.34 -57.67 2.8 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.569 -0.287 . . . . 71.43 111.446 -179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 211' ' ' ALA . . . . . 0.592 ' HA ' HD23 ' B' ' 214' ' ' LEU . . . -52.55 -26.79 14.21 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.575 0.583 . . . . 60.41 112.575 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 212' ' ' THR . . . . . 0.4 ' O ' ' HB2' ' B' ' 216' ' ' LYS . 7.3 t -69.58 -20.72 63.65 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 120.553 0.216 . . . . 43.13 111.024 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . 0.454 ' HB2' HD11 ' A' ' 17' ' ' LEU . 38.9 mt-10 -85.45 -30.56 23.42 Favored 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 109.065 -0.717 . . . . 75.53 109.065 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.592 HD23 ' HA ' ' B' ' 211' ' ' ALA . 3.6 mm? -65.01 -50.1 67.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.216 -0.902 . . . . 75.31 109.962 177.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 215' ' ' ILE . . . . . 0.47 HG13 ' HB1' ' A' ' 39' ' ' ALA . 82.3 mt -65.32 -30.98 51.9 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.864 -0.607 . . . . 71.02 110.74 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 216' ' ' LYS . . . . . 0.409 ' HD2' ' O ' ' B' ' 216' ' ' LYS . 0.5 OUTLIER -61.51 -29.8 70.22 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.892 -0.594 . . . . 71.23 110.799 -176.762 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' A' ' 13' ' ' GLU . 3.5 tm? -72.01 -41.39 67.63 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.493 -0.558 . . . . 73.31 109.493 178.2 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 218' ' ' ALA . . . . . . . . . . . . . . . -58.7 -39.11 79.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.755 -0.657 . . . . 73.24 111.262 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 219' ' ' ASN . . . . . 0.651 ' O ' ' HG2' ' B' ' 223' ' ' GLN . 85.1 m-20 -61.89 -34.19 75.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.222 -0.445 . . . . 75.15 111.31 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 220' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -65.64 -34.26 77.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.918 0.389 . . . . 74.54 111.271 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 221' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -79.67 -26.7 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.139 0.495 . . . . 74.23 110.406 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -79.27 -9.65 59.63 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.621 -0.718 . . . . 74.21 110.417 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 223' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' B' ' 219' ' ' ASN . 87.2 mm-40 -73.95 -10.58 59.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.323 -0.399 . . . . 62.43 110.79 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 224' ' ' ASN . . . . . 0.745 ' HB3' ' CG1' ' B' ' 227' ' ' ILE . 3.7 t30 -70.68 112.34 6.84 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.833 -0.803 . . . . 63.01 108.833 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 225' ' ' THR . . . . . . . . . . . . . 2.7 t -47.85 -38.44 16.12 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 114.461 1.282 . . . . 63.33 114.461 -170.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -99.06 14.99 27.28 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.369 0.877 . . . . 60.01 113.369 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 227' ' ' ILE . . . . . 0.745 ' CG1' ' HB3' ' B' ' 224' ' ' ASN . 8.1 mm -96.7 154.21 3.64 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 O-C-N 121.472 -0.767 . . . . 43.4 110.062 177.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 228' ' ' GLN . . . . . 0.78 ' HB2' ' HG3' ' B' ' 231' ' ' GLU . 9.2 mt-30 -91.87 138.76 31.29 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 108.467 -0.938 . . . . 55.42 108.467 171.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 36.6 m -58.0 -27.63 63.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.151 0.5 . . . . 64.24 110.26 178.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 230' ' ' GLY . . . . . . . . . . . . . . . -72.38 -11.6 76.22 Favored Glycine 0 N--CA 1.449 -0.437 0 CA-C-N 115.512 -0.767 . . . . 74.22 113.631 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 231' ' ' GLU . . . . . 0.78 ' HG3' ' HB2' ' B' ' 228' ' ' GLN . 32.4 mt-10 -85.61 -27.54 25.39 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 117.886 0.843 . . . . 73.34 109.489 178.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 232' ' ' VAL . . . . . . . . . . . . . 22.3 t -79.03 -39.48 21.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.356 -0.838 . . . . 70.34 110.175 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 233' ' ' SER . . . . . . . . . . . . . 17.6 p -61.08 -42.02 97.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.109 -0.496 . . . . 31.52 110.601 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 234' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.06 74.86 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.804 -0.635 . . . . 75.42 110.989 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 235' ' ' SER . . . . . 0.543 ' HA ' ' CE1' ' A' ' 7' ' ' PHE . 34.1 m -66.32 -37.45 85.41 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.867 0.365 . . . . 63.33 110.122 178.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 236' ' ' PHE . . . . . 0.661 ' CD1' HD12 ' A' ' 14' ' ' LEU . 9.6 t80 -64.6 -37.55 87.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.311 0.577 . . . . 72.22 109.463 176.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 237' ' ' MET . . . . . 0.817 ' HG3' ' HB3' ' A' ' 73' ' ' TYR . 11.4 ttm -66.39 -48.57 69.7 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.519 -0.764 . . . . 74.44 111.349 177.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 238' ' ' TRP . . . . . 0.485 ' O ' ' HG3' ' B' ' 242' ' ' ARG . 28.0 t-105 -62.14 -41.38 98.22 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.784 0.326 . . . . 74.51 110.981 179.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 239' ' ' ALA . . . . . 0.665 ' HB2' ' HB1' ' A' ' 11' ' ' ALA . . . -63.18 -39.29 94.23 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.84 0.353 . . . . 63.43 111.068 179.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 240' ' ' LEU . . . . . 0.717 HD13 ' HB3' ' A' ' 36' ' ' PHE . 42.5 tp -65.8 -36.12 82.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 72.53 110.503 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 241' ' ' ALA . . . . . 0.437 ' O ' ' HG ' ' A' ' 77' ' ' LEU . . . -62.1 -40.26 95.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.005 -0.543 . . . . 74.34 110.958 179.135 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 242' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' B' ' 238' ' ' TRP . 44.5 mtp180 -72.09 -37.27 69.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.221 -0.445 . . . . 70.14 110.073 -178.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 243' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -70.78 -40.93 72.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.803 -0.635 . . . . 63.04 111.013 -176.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 244' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -69.28 -28.12 66.02 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 111.93 0.344 . . . . 63.35 111.93 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 245' ' ' ALA . . . . . 0.409 ' HB1' ' HG2' ' A' ' 81' ' ' MET . . . -68.82 -18.65 64.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.022 0.439 . . . . 64.43 111.324 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 246' ' ' TRP . . . . . . . . . . . . . 89.8 t90 -61.94 -39.39 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.585 -0.734 . . . . 73.42 111.13 178.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -72.73 -5.77 40.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.768 -0.651 . . . . 64.53 112.457 -171.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 248' ' ' GLY . . . . . 0.553 ' HA2' ' SD ' ' B' ' 265' ' ' MET . . . -58.88 -27.77 62.42 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.469 -0.872 . . . . 33.41 111.502 175.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 249' ' ' SER . . . . . 0.678 ' HA ' ' HE3' ' B' ' 258' ' ' MET . 27.8 p -67.56 -21.2 65.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.558 -0.321 . . . . 75.14 111.426 -178.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 250' ' ' THR . . . . . . . . . . . . . 26.5 p -91.12 -12.13 36.47 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.06 0.457 . . . . 74.44 111.039 -176.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 251' ' ' SER . . . . . . . . . . . . . 26.1 t -67.07 -42.53 84.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.749 -0.659 . . . . 62.01 111.748 -172.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 252' ' ' PHE . . . . . 0.563 ' HD2' ' HG3' ' B' ' 261' ' ' LYS . 1.3 m-85 -150.61 -178.59 6.64 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.985 0.735 . . . . 74.12 112.985 -173.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 253' ' ' GLU . . . . . 0.514 ' HG3' HG23 ' B' ' 254' ' ' THR . 14.5 pt-20 -93.13 -53.05 4.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.685 -1.143 . . . . 72.52 110.753 -176.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 254' ' ' THR . . . . . 0.514 HG23 ' HG3' ' B' ' 253' ' ' GLU . 72.0 p -100.84 158.57 15.88 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.086 -0.506 . . . . 73.02 110.505 -178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 255' ' ' LYS . . . . . 0.412 ' HD2' ' HB3' ' A' ' 88' ' ' PHE . 21.8 ptmt -68.36 -31.25 70.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.425 -0.352 . . . . 73.12 111.306 -179.497 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 256' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -60.46 -45.51 93.44 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.029 0.442 . . . . 54.1 110.673 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 257' ' ' GLN . . . . . 0.553 ' O ' ' HG2' ' B' ' 261' ' ' LYS . 18.4 mt-30 -80.49 -35.69 34.4 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.99 -0.55 . . . . 63.23 110.129 -179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 258' ' ' MET . . . . . 0.678 ' HE3' ' HA ' ' B' ' 249' ' ' SER . 23.4 ttt -63.81 -44.89 91.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.512 -0.767 . . . . 61.53 111.447 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 259' ' ' GLN . . . . . 0.553 ' HA ' HD13 ' A' ' 85' ' ' ILE . 34.6 tt0 -61.3 -39.46 90.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.045 -0.525 . . . . 74.51 111.39 -178.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -68.0 -15.68 63.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.158 -0.474 . . . . 74.24 111.328 -177.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 261' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' B' ' 252' ' ' PHE . 31.9 mmmt -97.51 -5.82 35.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.204 -0.453 . . . . 72.35 110.897 -176.579 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 262' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -52.67 -54.18 36.95 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.011 0.434 . . . . 71.3 110.477 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 263' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -68.02 -33.05 73.86 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.091 -0.504 . . . . 70.33 110.561 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.21 -40.38 78.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.72 -0.673 . . . . 74.24 111.763 -176.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 265' ' ' MET . . . . . 0.553 ' SD ' ' HA2' ' B' ' 248' ' ' GLY . 21.1 ptp -79.82 -25.61 40.77 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.488 0.661 . . . . 73.05 109.459 -177.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 266' ' ' MET . . . . . 0.43 ' HA ' ' CD2' ' B' ' 269' ' ' TYR . 44.5 mtp -78.32 -42.62 30.16 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.168 -0.924 . . . . 61.05 112.681 -176.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 267' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -63.61 -27.34 69.17 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.065 0.394 . . . . 64.23 112.065 -162.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 268' ' ' TYR . . . . . 0.579 ' O ' ' HG2' ' B' ' 272' ' ' ARG . 30.2 p90 -94.15 -8.12 40.37 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.277 -0.569 . . . . 74.24 111.133 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 269' ' ' TYR . . . . . 0.43 ' CD2' ' HA ' ' B' ' 266' ' ' MET . 5.5 m-30 -62.38 -49.69 74.54 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 110.004 -0.369 . . . . 74.44 110.004 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 270' ' ' MET . . . . . 0.469 ' O ' ' HG3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -53.54 -41.19 66.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.749 0.785 . . . . 63.01 109.427 175.314 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 271' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -86.75 8.85 20.91 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.516 -1.22 . . . . 74.33 111.66 -172.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 272' ' ' ARG . . . . . 0.579 ' HG2' ' O ' ' B' ' 268' ' ' TYR . 6.0 mmm-85 -84.09 -42.44 16.09 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 121.588 -0.695 . . . . 74.11 110.159 -174.245 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 273' ' ' TYR . . . . . 0.608 ' HB3' ' HG3' ' A' ' 37' ' ' MET . 0.0 OUTLIER -99.61 14.94 28.26 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.698 -0.683 . . . . 71.12 110.318 -178.653 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 274' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -58.45 -58.67 7.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.736 -0.666 . . . . 75.41 109.64 176.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -64.2 -35.38 80.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.162 -0.927 . . . . 74.12 110.879 179.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 276' ' ' MET . . . . . . . . . . . . . 56.8 mtt -62.45 -42.43 99.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.857 -0.61 . . . . 70.31 110.285 178.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 277' ' ' LEU . . . . . 0.596 HD22 ' HG2' ' A' ' 66' ' ' MET . 1.6 tt -70.73 -38.9 73.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.208 -0.906 . . . . 54.45 110.088 -176.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 278' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -61.72 -35.37 77.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.145 0.498 . . . . 71.25 110.048 175.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 279' ' ' ALA . . . . . . . . . . . . . . . -74.54 -13.01 60.62 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.577 -0.738 . . . . 73.44 111.271 179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 280' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -99.69 -9.25 23.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.571 0.701 . . . . 63.23 109.351 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 281' ' ' MET . . . . . 0.434 ' HE2' ' CD2' ' B' ' 277' ' ' LEU . 20.2 mmt -84.14 -170.07 2.9 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.85 -1.068 . . . . 65.44 109.786 174.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 282' ' ' GLU . . . . . 0.607 ' HA ' HD12 ' B' ' 285' ' ' ILE . 22.8 mt-10 72.09 -31.68 0.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.248 -0.887 . . . . 74.11 113.243 169.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -54.62 -54.79 36.92 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 45.43 110.954 177.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -68.4 -25.8 65.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.948 -0.569 . . . . 73.13 110.43 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 285' ' ' ILE . . . . . 0.607 HD12 ' HA ' ' B' ' 282' ' ' GLU . 54.6 mt -71.21 -56.24 11.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.18 -0.464 . . . . 60.21 110.76 -178.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 286' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' B' ' 282' ' ' GLU . 12.1 pt-20 -65.37 -27.91 68.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.063 0.458 . . . . 74.11 110.882 -178.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 287' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -94.53 10.3 35.18 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.431 -0.35 . . . . 72.34 111.497 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 288' ' ' PHE . . . . . 0.475 ' CB ' ' HB3' ' A' ' 55' ' ' LYS . 58.7 t80 -59.78 -48.81 80.2 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 110.18 -0.304 . . . . 74.41 110.18 177.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 289' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -65.42 -16.97 64.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.331 -0.395 . . . . 72.35 110.936 177.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 290' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -82.1 -53.82 5.78 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.357 -0.608 . . . . 73.32 109.357 177.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 291' ' ' TYR . . . . . 0.656 ' O ' ' HG3' ' B' ' 295' ' ' GLN . 62.1 m-85 -64.62 -48.58 74.37 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.072 -0.513 . . . . 75.13 111.358 179.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 292' ' ' ARG . . . . . . . . . . . . . 10.6 tpp85 -61.03 -14.89 26.47 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.97 0.414 . . . . 73.34 110.979 -177.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -98.81 -16.2 18.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.273 -0.421 . . . . 72.52 111.381 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 294' ' ' THR . . . . . . . . . . . . . 21.0 p -119.02 8.5 11.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.171 0.51 . . . . 75.11 111.21 -176.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 295' ' ' GLN . . . . . 0.656 ' HG3' ' O ' ' B' ' 291' ' ' TYR . 69.2 mt-30 -65.8 153.97 40.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.471 -0.786 . . . . 63.43 111.882 -177.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 296' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt . . . . . 0 C--N 1.316 -0.853 0 CA-C-N 114.689 -1.141 . . . . 70.12 109.288 179.258 . . . . . . . . 0 0 . 1 stop_ save_